124 SMILES Strings for Proteasome subunit beta type-10

Compound Name
SMILES String
CC(C)(C)NC(=O)CC[C@H](NC(=O)CCNC(=O)CCl)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)NCc1cccc2ccccc12 |r|
CC(C)(C)NC(=O)CC[C@H](NC(=O)CCNC(=O)CCl)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCc1cccc2ccccc12 |r|
CC(C)(C)OC(=O)N[C@@H](Cc1ccc(OCc2ccccc2)cc1)C(=O)NCC(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
CC(C)C[C@H](NC(=O)CN1CCCCCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCc1ccc(C)cc1)C(=O)[C@@]1(C)CO1 |r|
CC(C)C[C@H](NC(=O)CN1CCCCCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r|
CC(C)C[C@H](NC(=O)CN1CCOCC1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)CNC(=O)c1cc(Cl)ccc1Cl)B(O)O
CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)CS(F)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)CS(F)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)CS(F)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1ccc(CN)cc1)CS(F)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)c1cccc(n1)-c1ccccc1)[C@@H](C)O)B(O)O
CC(C)C[C@H](NC(=O)[C@@H](NC(=O)c1cnc(C)s1)C1CCCCC1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCCN1C(C)=O)B(O)O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](Cc1ccc(N)cc1)CS(F)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](Cc1ccc(CN)cc1)CS(F)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CN=[N+]=[N-])C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)CS(F)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(C)=O)C(=O)N[C@@H](Cc1ccc(CN)cc1)CS(F)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c1cc(Cl)ccc1Cl)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c1ccc(nc1)-c1ccccc1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c1ccccc1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c1cnc(C)s1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c1cnccn1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC1CCC(C)CC1)NC(=O)c1cnc(C)s1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r,wU:4.3,wD:29.31,8.8,(44.64,-35.62,;44.64,-37.16,;45.97,-37.93,;43.3,-37.93,;43.3,-39.47,;41.97,-40.24,;40.64,-39.47,;40.64,-37.93,;39.3,-40.24,;39.3,-41.78,;40.63,-42.55,;40.63,-44.08,;41.96,-44.85,;43.29,-44.08,;44.62,-44.86,;43.29,-42.54,;41.96,-41.77,;37.97,-39.47,;36.63,-40.24,;36.63,-41.78,;35.31,-39.47,;33.9,-40.09,;32.88,-38.95,;33.65,-37.62,;33.03,-36.21,;35.15,-37.94,;44.64,-40.24,;44.64,-41.78,;45.97,-39.47,;47.3,-40.24,;47.3,-41.78,;48.64,-42.55,;48.63,-44.09,;49.96,-44.86,;51.3,-44.09,;52.63,-44.86,;53.96,-44.09,;51.29,-42.55,;49.96,-41.78,;48.64,-39.47,;49.97,-40.24,;51.3,-39.46,;52.64,-40.24,;50.52,-38.13,;52.07,-38.12,)|
CC(C)C[C@H](NC(=O)[C@H](CC1CCC(CC1)C1CCCCC1)NC(=O)c1cnc(C)s1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r,wU:4.3,wD:34.37,8.8,(16.93,-1.71,;16.93,-3.25,;18.27,-4.02,;15.6,-4.02,;15.6,-5.56,;14.27,-6.33,;12.93,-5.56,;12.93,-4.02,;11.6,-6.33,;11.6,-7.87,;12.93,-8.64,;14.25,-7.86,;15.59,-8.63,;15.59,-10.17,;14.25,-10.93,;12.94,-10.17,;16.91,-10.94,;16.91,-12.47,;18.22,-13.24,;19.56,-12.48,;19.56,-10.94,;18.23,-10.17,;10.26,-5.56,;8.93,-6.33,;8.93,-7.87,;7.6,-5.56,;6.2,-6.18,;5.18,-5.04,;5.95,-3.71,;5.32,-2.3,;7.45,-4.03,;16.93,-6.33,;16.93,-7.87,;18.27,-5.56,;19.6,-6.33,;19.6,-7.87,;20.93,-8.64,;20.93,-10.18,;22.26,-10.95,;23.59,-10.18,;24.93,-10.95,;26.26,-10.18,;23.59,-8.64,;22.26,-7.87,;20.93,-5.56,;22.27,-6.33,;23.6,-5.55,;24.94,-6.33,;22.82,-4.22,;24.37,-4.21,)|
CC(C)C[C@H](NC(=O)[C@H](CC1CCC2CCCCC2C1)NC(=O)c1cnc(C)s1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC1CCCC2CCCCC12)NC(=O)c1cnc(C)s1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CC1CCCCC1)NC(=O)c1cnc(C)s1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CCC1CCCCC1)NC(=O)c1cnc(C)s1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](CCc1ccccc1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)[C@@]1(C)CO1 |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)NCC(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CC(C)(C)F)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CC(F)(F)F)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CO)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)cc1)B(O)O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(=O)NCC(C)(C)C)NS(=O)(=O)c1ccc(C)cc1)B(O)O |r|
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O |r|
CC(C)C[C@H](NC(=O)c1cnc(C)s1)C(=O)N[C@@H](CC1CCC(C)CC1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r,wU:17.18,wD:29.31,4.3,(43.01,-8.6,;41.68,-9.38,;41.69,-10.91,;40.35,-8.61,;40.35,-7.07,;39.02,-6.3,;37.68,-7.07,;37.68,-8.61,;36.36,-6.3,;34.95,-6.92,;33.93,-5.77,;34.7,-4.45,;34.08,-3.04,;36.2,-4.77,;41.69,-6.3,;41.69,-4.76,;43.02,-7.07,;44.35,-6.3,;44.35,-4.76,;45.69,-3.99,;47.02,-4.77,;48.35,-4.01,;48.35,-2.47,;49.69,-1.7,;47.02,-1.69,;45.68,-2.46,;45.69,-7.07,;45.69,-8.61,;47.02,-6.3,;48.35,-7.07,;48.35,-8.61,;49.69,-9.38,;49.68,-10.92,;51.01,-11.69,;52.35,-10.92,;53.68,-11.69,;55.01,-10.92,;52.34,-9.37,;51.01,-8.61,;49.69,-6.3,;51.02,-7.07,;52.35,-6.29,;53.69,-7.07,;51.57,-4.95,;53.12,-4.95,)|
CC(C)C[C@H](NC(=O)c1cnc(C)s1)C(=O)N[C@@H](CC1CCC(CC1)C1CCCCC1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r,wU:17.18,wD:34.37,4.3,(15.13,-25.2,;13.81,-25.98,;13.82,-27.51,;12.48,-25.22,;12.48,-23.68,;11.14,-22.91,;9.81,-23.68,;9.81,-25.22,;8.48,-22.91,;7.08,-23.52,;6.05,-22.38,;6.82,-21.05,;6.2,-19.65,;8.32,-21.38,;13.81,-22.91,;13.81,-21.37,;15.14,-23.68,;16.48,-22.91,;16.48,-21.37,;17.81,-20.6,;19.14,-21.38,;20.46,-20.62,;20.48,-19.07,;19.14,-18.3,;17.8,-19.06,;21.81,-18.31,;23.14,-19.09,;24.47,-18.33,;24.48,-16.79,;23.15,-16.01,;21.81,-16.77,;17.81,-23.68,;17.81,-25.22,;19.14,-22.91,;20.48,-23.68,;20.48,-25.22,;21.81,-25.99,;21.8,-27.53,;23.14,-28.3,;24.47,-27.53,;25.81,-28.3,;27.14,-27.52,;24.47,-25.98,;23.13,-25.22,;21.81,-22.91,;23.15,-23.68,;24.48,-22.9,;25.81,-23.68,;23.7,-21.56,;25.25,-21.56,)|
CC(C)C[C@H](NC(=O)c1cnc(C)s1)C(=O)N[C@@H](CC1CCC2CCCCC2C1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)c1cnc(C)s1)C(=O)N[C@@H](CC1CCCC2CCCCC12)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)c1cnc(C)s1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)c1cnc(C)s1)C(=O)N[C@@H](CCC1CCCCC1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](C1CCCCC1)C(=O)[C@@]1(C)CO1 |r|
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CC1CC2CCC1C2)C(=O)[C@@]1(C)CO1 |r,TLB:35:36:40.39:42|
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CC1CCC(C)CC1)C(=O)[C@@]1(C)CO1 |r,wU:7.7,34.36,20.29,wD:3.2,45.48,(66.53,-40.02,;65.2,-39.25,;63.87,-40.02,;65.2,-37.71,;63.87,-36.94,;62.53,-37.71,;62.53,-39.25,;61.2,-36.94,;61.2,-35.4,;60.1,-34.32,;60.49,-32.83,;59.39,-31.75,;57.9,-32.16,;56.8,-31.08,;55.32,-31.5,;57.52,-33.66,;58.62,-34.74,;59.87,-37.71,;58.53,-36.94,;58.53,-35.4,;57.2,-37.71,;55.86,-36.94,;54.53,-37.71,;53.2,-36.94,;51.87,-37.71,;51.86,-39.25,;53.21,-40.02,;54.53,-39.25,;57.2,-39.25,;58.53,-40.02,;59.86,-40.79,;66.53,-36.94,;66.53,-35.4,;67.87,-37.71,;69.2,-36.94,;69.2,-35.4,;68,-34.21,;66.57,-34.76,;65.38,-33.8,;65.61,-32.28,;64.41,-31.32,;67.05,-31.71,;68.24,-32.69,;70.53,-37.71,;70.53,-39.25,;71.87,-36.94,;73.2,-37.71,;71.09,-35.6,;72.64,-35.59,)|
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CC1CCC(CC1)C1CCCCC1)C(=O)[C@@]1(C)CO1 |r,wU:7.7,34.36,20.29,wD:3.2,50.54,(44.99,-12.76,;43.66,-11.99,;42.32,-12.76,;43.66,-10.45,;42.32,-9.68,;40.99,-10.45,;40.99,-11.99,;39.65,-9.68,;39.65,-8.14,;38.55,-7.06,;38.94,-5.57,;37.85,-4.49,;36.36,-4.9,;35.26,-3.82,;33.77,-4.24,;35.97,-6.4,;37.08,-7.48,;38.32,-10.45,;36.99,-9.68,;36.99,-8.14,;35.65,-10.45,;34.32,-9.68,;32.99,-10.45,;31.65,-9.68,;30.32,-10.45,;30.32,-11.99,;31.66,-12.76,;32.99,-11.98,;35.65,-11.99,;36.99,-12.76,;38.31,-13.53,;44.99,-9.68,;44.99,-8.14,;46.32,-10.45,;47.66,-9.68,;47.66,-8.14,;46.46,-6.95,;45.03,-7.49,;43.83,-6.54,;44.06,-5.02,;45.5,-4.45,;46.69,-5.43,;42.85,-4.07,;43.07,-2.53,;41.87,-1.58,;40.43,-2.15,;40.21,-3.68,;41.42,-4.64,;48.99,-10.45,;48.99,-11.99,;50.32,-9.68,;51.66,-10.45,;49.54,-8.34,;51.09,-8.33,)|
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CC1CCC2CCCCC2C1)C(=O)[C@@]1(C)CO1 |r|
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CC1CCCC2CCCCC12)C(=O)[C@@]1(C)CO1 |r|
CC(C)[C@H](NC(=O)[C@H](Cc1ccc(CN)cc1)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](CCC1CCCCC1)C(=O)[C@@]1(C)CO1 |r|
CC(O)[C@@H](NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
CC(O)[C@@H](NC(=O)c1ccc(OCc2ccccc2)cc1)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
CCC(C)\C=C(/C)C1=Cc2cc3C=C(OC)C(O)(CC(C)=O)C(=O)c3c(O)c2CO1 |t:7,12|
CCC(C)\C=C(/C)c1cc2C(=O)c3cc(OC)c(O)c(O)c3C(=O)c2cn1
CCC(C)\C=C(/C)c1cc2C=C3C=C(OC)C(=O)C(N)=C3C(=O)c2cn1 |c:19,t:10,12|
CCCCCCC(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)[C@@]1(CO[Si](C)(C)C(C)(C)C)CO1 |r|
CCCC[C@H](NC(=O)[C@@H]1CC(F)(F)CN1C(=O)[C@H](C)NC(=O)CN=[N+]=[N-])C(=O)N[C@@H](CC1CCCCC1)C(=O)[C@@]1(C)CO1 |r|
CCCC[C@H](NC(=O)[C@@H]1CC(F)(F)CN1C(=O)[C@H](C)NC(=O)CN=[N+]=[N-])C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r|
CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)CN=[N+]=[N-])C(=O)N[C@@H](CC1CCCCC1)C(=O)[C@@]1(C)CO1 |r|
CCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)CN=[N+]=[N-])C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r|
CCc1cccc(C[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)c2cnccn2)B(O)O)c1 |r|
CNC(=O)[C@H](C[C@]1(O)C(=O)Nc2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C |r|
COC(=O)CCNC(=O)[C@H](C[C@]1(O)C(=O)Nc2ccccc12)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C |r|
COC1CCC(C[C@H](NC(=O)[C@@H](NC(=O)[C@H](Cc2ccc(CN)cc2)NC(=O)[C@H](Cc2ccccc2)N=[N+]=[N-])C(C)C)C(=O)[C@@]2(C)CO2)CC1 |r,wU:15.15,7.6,28.37,wD:11.40,44.46,(14.69,-3.96,;16.13,-3.4,;17.33,-4.36,;17.09,-5.88,;18.29,-6.84,;19.72,-6.29,;20.92,-7.49,;20.92,-9.03,;19.58,-9.8,;18.25,-9.03,;18.25,-7.49,;16.92,-9.8,;15.58,-9.03,;14.25,-9.8,;14.25,-11.34,;12.91,-9.03,;12.91,-7.49,;11.81,-6.41,;12.21,-4.91,;11.11,-3.83,;9.62,-4.25,;8.52,-3.17,;7.03,-3.58,;9.23,-5.75,;10.34,-6.82,;11.58,-9.8,;10.25,-9.03,;10.25,-7.49,;8.91,-9.8,;7.58,-9.03,;6.25,-9.8,;4.91,-9.02,;3.58,-9.79,;3.58,-11.33,;4.92,-12.1,;6.25,-11.33,;8.91,-11.34,;10.25,-12.11,;11.57,-12.88,;16.92,-11.34,;18.25,-12.11,;15.58,-12.11,;22.25,-9.8,;22.25,-11.34,;23.58,-9.02,;24.92,-9.8,;22.8,-7.68,;24.35,-7.68,;19.96,-4.77,;18.76,-3.8,)|
COC1CCC(C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c2cnc(C)s2)C(=O)N[C@@H](Cc2ccc(CN)cc2)\C=C\S(C)(=O)=O)CC1 |r,wU:7.6,wD:28.29,11.11,(51.98,-17.05,;50.65,-16.28,;49.31,-17.04,;49.3,-18.58,;47.97,-19.35,;46.64,-18.57,;45.31,-19.34,;45.31,-20.88,;43.98,-21.65,;42.64,-20.88,;42.64,-19.34,;41.31,-21.65,;41.31,-23.19,;42.64,-23.95,;43.96,-23.17,;42.65,-25.48,;39.97,-20.88,;38.64,-21.65,;38.64,-23.19,;37.31,-20.88,;35.91,-21.49,;34.89,-20.35,;35.66,-19.02,;35.03,-17.62,;37.16,-19.35,;46.64,-21.65,;46.64,-23.19,;47.98,-20.88,;49.31,-21.65,;49.31,-23.19,;50.64,-23.96,;50.64,-25.5,;51.97,-26.27,;53.3,-25.5,;54.64,-26.27,;55.97,-25.49,;53.3,-23.95,;51.97,-23.19,;50.64,-20.88,;51.98,-21.65,;53.31,-20.87,;54.64,-21.65,;52.53,-19.53,;54.08,-19.53,;46.64,-17.03,;47.98,-16.27,)|
COC1CCC(C[C@H](NC(=O)[C@H](Cc2ccc(OC)cc2)NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)[C@@]2(C)CO2)CC1 |r,wU:24.25,7.6,wD:11.11,38.40,(13.35,-2.82,;14.93,-2.4,;16.08,-3.55,;17.66,-3.13,;18.81,-4.27,;18.38,-5.85,;19.54,-7,;19.54,-8.54,;18.21,-9.31,;16.87,-8.54,;16.87,-7,;15.54,-9.31,;15.54,-10.85,;16.87,-11.62,;16.87,-13.16,;18.2,-13.93,;19.53,-13.16,;20.87,-13.92,;20.87,-15.46,;19.53,-11.61,;18.19,-10.85,;14.21,-8.54,;12.87,-9.31,;12.87,-10.85,;11.54,-8.54,;11.54,-7,;10.21,-9.31,;8.87,-8.54,;8.87,-7,;7.54,-9.31,;6.21,-8.54,;6.22,-7,;4.89,-6.23,;3.55,-6.99,;3.55,-8.53,;4.88,-9.31,;20.87,-9.31,;20.87,-10.85,;22.2,-8.53,;23.54,-9.31,;21.43,-7.19,;22.97,-7.19,;16.82,-6.28,;15.66,-5.13,)|
COC1CCC(C[C@H](NC(=O)c2cnc(C)s2)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc2ccc(CN)cc2)\C=C\S(C)(=O)=O)CC1 |r,wU:20.21,wD:28.29,7.6,(69.02,-12.6,;69.02,-11.06,;67.69,-10.29,;66.36,-11.05,;65.03,-10.29,;65.03,-8.75,;63.7,-7.99,;63.7,-6.45,;62.37,-5.68,;61.03,-6.45,;61.03,-7.99,;59.71,-5.68,;58.3,-6.29,;57.28,-5.15,;58.05,-3.83,;57.43,-2.42,;59.55,-4.15,;65.03,-5.68,;65.03,-4.14,;66.37,-6.45,;67.7,-5.68,;67.7,-4.14,;69.04,-3.37,;69.04,-1.83,;70.37,-4.14,;69.04,-6.45,;69.04,-7.99,;70.37,-5.68,;71.7,-6.45,;71.7,-7.99,;73.04,-8.76,;73.03,-10.3,;74.36,-11.07,;75.7,-10.3,;77.03,-11.07,;78.36,-10.3,;75.69,-8.75,;74.36,-7.99,;73.04,-5.68,;74.37,-6.45,;75.7,-5.67,;77.04,-6.45,;74.92,-4.33,;76.47,-4.33,;66.36,-7.98,;67.69,-8.75,)|
COC1CCN(CC1)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(OC)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r|
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)N=[N+]=[N-])C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
COC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)c1cnc(C)s1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
CO[C@@H]1CCCN(C1)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(OC)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r|
CO[C@H]1CCN(C1)C(=O)N[C@H](C)C(=O)N[C@@H](Cc1ccc(OC)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r|
COc1ccc(C[C@H](NC(=O)[C@@H](C)NC(=O)C2=C(C)c3ccccc3C2)C(=O)N[C@@H](CC2CCCCC2)C(=O)[C@@]2(C)CO2)cc1 |r,c:16|
COc1ccc(C[C@H](NC(=O)[C@@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@@H](C)NC(=O)[C@H]2CC[C@H](O)CC2)C(=O)N[C@@H](CC2=CCCC2)C(=O)[C@@]2(C)CO2)cc1 |r,wU:19.19,26.27,wD:16.15,35.37,7.6,11.11,t:29,(25.81,-33.19,;24.47,-33.96,;23.14,-33.19,;23.14,-31.65,;21.81,-30.89,;20.48,-31.65,;19.15,-30.88,;19.15,-29.34,;17.81,-28.57,;16.48,-29.34,;16.48,-30.88,;15.15,-28.57,;15.15,-27.03,;13.81,-29.34,;12.48,-28.57,;12.48,-27.03,;11.14,-29.34,;9.81,-28.57,;8.47,-29.34,;8.47,-30.89,;7.14,-31.65,;9.81,-31.65,;11.14,-30.89,;20.48,-28.57,;20.48,-27.03,;21.81,-29.34,;23.14,-28.57,;23.14,-27.03,;24.23,-25.95,;25.75,-26.18,;26.46,-24.81,;25.37,-23.72,;24,-24.42,;24.48,-29.34,;24.48,-30.88,;25.81,-28.57,;27.14,-29.34,;25.05,-27.23,;26.58,-27.23,;20.48,-33.2,;21.82,-33.96,)|
COc1ccc(C[C@H](NC(=O)[C@@H](C)NC(=O)[C@H]2CC[C@H](O)CC2)C(=O)N[C@@H](Cc2ccccc2)C(=O)[C@@]2(C)CO2)cc1 |r,wU:26.27,19.19,wD:16.15,11.11,7.6,36.38,(66.97,-27.92,;66.97,-26.38,;65.64,-25.61,;64.3,-26.38,;62.97,-25.61,;62.98,-24.07,;61.64,-23.3,;61.65,-21.76,;60.31,-20.99,;58.98,-21.76,;58.98,-23.3,;57.65,-20.98,;57.65,-19.44,;56.31,-21.75,;54.98,-20.98,;54.98,-19.44,;53.64,-21.75,;52.31,-20.97,;50.98,-21.73,;50.97,-23.27,;49.63,-24.04,;52.3,-24.05,;53.65,-23.29,;62.98,-20.99,;62.98,-19.45,;64.31,-21.76,;65.65,-21,;65.65,-19.46,;66.85,-18.48,;68.28,-19.04,;69.47,-18.07,;69.23,-16.55,;67.78,-16,;66.59,-16.97,;66.98,-21.77,;66.98,-23.31,;68.31,-20.99,;69.64,-21.76,;67.53,-19.65,;69.08,-19.65,;64.3,-23.3,;65.63,-24.06,)|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](C2CCCCC2)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2=CCCC2)C(=O)[C@@]2(C)CO2)cc1 |r,t:29|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CC3CCC2C3)C(=O)[C@@]2(C)CO2)cc1 |r,TLB:27:28:32.31:34|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CCC(C)CC2)C(=O)[C@@]2(C)CO2)cc1 |r,wU:11.11,26.27,wD:7.6,37.39,(72.95,-43.35,;72.95,-41.81,;71.61,-41.05,;70.28,-41.81,;68.95,-41.05,;68.96,-39.5,;67.62,-38.74,;67.62,-37.2,;66.29,-36.43,;64.96,-37.2,;64.96,-38.74,;63.63,-36.43,;63.63,-34.89,;62.3,-37.2,;60.96,-36.43,;60.96,-34.89,;59.63,-37.2,;58.3,-36.43,;58.31,-34.89,;56.98,-34.12,;55.64,-34.88,;55.64,-36.42,;56.97,-37.2,;68.96,-36.43,;68.96,-34.89,;70.29,-37.2,;71.62,-36.43,;71.62,-34.89,;70.46,-33.74,;70.89,-32.17,;69.74,-31.02,;68.17,-31.44,;67.01,-30.29,;67.75,-33.02,;68.9,-34.18,;72.95,-37.2,;72.95,-38.74,;74.29,-36.42,;75.62,-37.2,;73.51,-35.08,;75.05,-35.08,;70.28,-38.74,;71.61,-39.5,)|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CCC(CC2)C(F)(F)F)C(=O)[C@@]2(C)CO2)cc1 |r,wU:11.11,26.27,wD:7.6,40.42,(72.01,-14.71,;72.01,-13.17,;70.67,-12.4,;69.34,-13.17,;68.01,-12.4,;68.02,-10.86,;66.69,-10.09,;66.69,-8.55,;65.35,-7.79,;64.02,-8.55,;64.02,-10.09,;62.69,-7.79,;62.69,-6.25,;61.36,-8.55,;60.02,-7.79,;60.02,-6.25,;58.69,-8.55,;57.36,-7.79,;57.37,-6.24,;56.04,-5.48,;54.71,-6.24,;54.7,-7.78,;56.04,-8.56,;68.02,-7.79,;68.02,-6.25,;69.35,-8.55,;70.68,-7.79,;70.68,-6.25,;69.52,-5.1,;69.95,-3.53,;68.8,-2.38,;67.23,-2.8,;66.81,-4.38,;67.96,-5.53,;66.07,-1.66,;65.02,-.61,;66.24,.03,;64.38,-1.83,;72.01,-8.55,;72.01,-10.09,;73.34,-7.78,;74.68,-8.55,;72.57,-6.44,;74.11,-6.44,;69.34,-10.09,;70.67,-10.86,)|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CCC(CC2)C2CCCCC2)C(=O)[C@@]2(C)CO2)cc1 |r,wU:11.11,26.27,wD:7.6,42.45,(44.27,-16.34,;44.27,-14.81,;42.93,-14.04,;41.6,-14.81,;40.27,-14.04,;40.28,-12.5,;38.95,-11.73,;38.95,-10.2,;37.62,-9.43,;36.28,-10.2,;36.28,-11.73,;34.95,-9.43,;34.95,-7.89,;33.62,-10.2,;32.29,-9.43,;32.29,-7.89,;30.96,-10.2,;29.63,-9.43,;29.64,-7.89,;28.31,-7.12,;26.98,-7.88,;26.97,-9.42,;28.3,-10.2,;40.28,-9.43,;40.28,-7.89,;41.61,-10.2,;42.94,-9.43,;42.94,-7.89,;41.78,-6.74,;40.22,-7.18,;39.07,-6.02,;39.49,-4.45,;41.06,-4.03,;42.21,-5.16,;38.34,-3.29,;38.77,-1.71,;37.62,-.56,;36.05,-.98,;35.62,-2.55,;36.77,-3.71,;44.27,-10.2,;44.27,-11.73,;45.6,-9.42,;46.94,-10.2,;44.83,-8.08,;46.37,-8.08,;41.6,-11.73,;42.93,-12.5,)|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CCC(F)(F)CC2)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CCC3CCCCC3C2)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CCCC3CCCCC23)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2CCCCC2)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CCC2CCCCC2)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](C[C@@H]2CCCC3CCCCC23)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](C[C@@H]2CCCc3ccccc23)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](C[C@H]2CCCC3CCCCC23)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](C[C@H]2CCCc3ccccc23)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](Cc2ccccc2)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(C[C@H](NC(=O)c2cccc(=O)[nH]2)C(=O)N[C@@H](Cc2ccccc2)C(=O)[C@@]2(C)CO2)cc1 |r|
COc1ccc(cc1)[C@@H](O)[C@H](NC(=O)[C@H](C)NC(=O)CN1CCOCC1)C(=O)N[C@@H](CC1=CCCC1)C(=O)[C@@]1(C)CO1 |t:33|
C[C@@H](NC(=O)C1=C(C)c2ccccc2C1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC1CCCCC1)C(=O)[C@@]1(C)CO1 |r,c:5|
C[C@@H](NC(=O)C1=C(C)c2ccccc2C1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r,c:5|
C[C@@H](NC(=O)C1=C(C)c2ccccc2C1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)\C=C\S(C)(=O)=O |r,c:5|
C[C@@H](NC(=O)CN1CCOCC1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC1CCCCC1)C(=O)[C@@]1(C)CO1 |r|
C[C@@H](NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
C[C@@]1(CO1)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)c1cccc(=O)[nH]1 |r|
C[C@H](NC(=O)Cc1cccc(Oc2ccccc2)c1)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
C[C@H](NC(=O)N1CCC(CC1)NC(=O)c1nccs1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r|
C[C@H](NC(=O)[C@@H](N)Cc1ccc(OCc2ccccc2)cc1)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C[C@@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCC(C)(C)C |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCC1CCCCC1 |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCCC(O)=O |r|
C[C@H](NC(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1cccc2ccccc12 |r|
C[C@H](NC(=O)[C@H]1CCCN1C(C)=O)C(=O)N[C@@H](Cc1ccccc1)B(O)O |r|
C[C@H](NC(=O)c1ccc(OCc2ccccc2)cc1)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
C[C@H](NC(=O)c1cccc(=O)[nH]1)C(=O)N[C@@H](Cc1ccccc1)C(=O)[C@@]1(C)CO1 |r|
Cc1ccc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CCC(=O)NC(C)(C)C)NC(=O)CCNC(=O)C(=C\c2ccco2)\C#N)cc1 |r|
Cc1ncc(s1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)N[C@@H](Cc1ccc(CN)cc1)\C=C\S(C)(=O)=O |r|
Fc1ccccc1CNC(=O)[C@@H]1CCCCOc2cccc(CCC(=O)N[C@@H](CC(=O)N3CCC[C@@H]3C3CC3)C(=O)N1)c2 |r|
NCCCC[C@H](NC(=O)[C@@H](N)Cc1ccc(OCc2ccccc2)cc1)C(=O)N[C@@H](C[C@]1(O)C(=O)Nc2ccccc12)C(=O)NCc1ccccc1 |r|
[H][C@@]12CCCC[C@]1([H])[C@@H](C[C@H](NC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](C)NC(=O)CN1CCOCC1)C(=O)[C@@]1(C)CO1)CCC2 |r|
[H][C@]12CCCC[C@@]1([H])[C@H](C[C@H](NC(=O)[C@H](Cc1ccc(OC)cc1)NC(=O)[C@H](C)NC(=O)CN1CCOCC1)C(=O)[C@@]1(C)CO1)CCC2 |r|
[H][C@]12CC[C@]([H])(O1)[C@@H](C2)C(=O)N[C@@H](Cc1coc2ccccc12)B(O)O |r|
[H][C@]12CN3CC(=C1)[C@]1([H])CCN(C[C@@]1([H])CC\C=C/CCCC3)CCCC\C=C/CC2 |r,c:5,19,30|