SMILES for N-terminal Xaa-Pro-Lys N-methyltransferase 1

76 SMILES Strings for N-terminal Xaa-Pro-Lys N-methyltransferase 1

Compound Name

SMILES String

CC(C)(NC(=O)OC1CCCCC1)c1csc(n1)-c1ccc(F)cc1

CC(C)(NC(=O)O[C@@H]1CN2CCC1CC2)c1csc(n1)-c1ccc(Br)cc1 |r,wU:7.6,(-.9,2.75,;-.9,1.21,;.43,1.98,;-2.44,1.21,;-3.21,2.54,;-2.44,3.87,;-4.75,2.54,;-5.52,1.21,;-7.06,1.21,;-7.83,-.13,;-7.06,-1.46,;-5.52,-1.46,;-4.75,-.13,;-6.1,.59,;-6.5,-.9,;-.13,-.13,;-.61,-1.59,;.64,-2.5,;1.88,-1.59,;1.41,-.13,;3.37,-1.99,;4.46,-.9,;5.95,-1.3,;6.34,-2.79,;7.83,-3.19,;5.26,-3.87,;3.77,-3.48,)|

BDBM50593134

CC(C)(NC(=O)O[C@@H]1CN2CCC1CC2)c1csc(n1)-c1ccc(CCC(O)=O)cc1 |r,wU:7.6,(-4.96,3.4,;-4.96,1.86,;-3.63,2.63,;-6.5,1.86,;-7.27,3.19,;-6.5,4.53,;-8.81,3.19,;-9.58,1.86,;-11.12,1.86,;-11.89,.53,;-11.12,-.81,;-9.58,-.81,;-8.81,.53,;-10.16,1.24,;-10.56,-.24,;-4.19,.53,;-4.67,-.94,;-3.42,-1.84,;-2.18,-.94,;-2.65,.53,;-.69,-1.34,;.4,-.25,;1.88,-.65,;2.28,-2.13,;3.77,-2.53,;4.86,-1.44,;6.35,-1.84,;7.43,-.75,;6.75,-3.34,;1.2,-3.22,;-.29,-2.83,)|

BDBM50593129

CC(C)(NC(=O)O[C@@H]1CN2CCC1CC2)c1csc(n1)-c1ccc(Cl)cc1 |r,wU:7.6,(-.9,2.75,;-.9,1.21,;.43,1.98,;-2.44,1.21,;-3.21,2.54,;-2.44,3.87,;-4.75,2.54,;-5.52,1.21,;-7.06,1.21,;-7.83,-.13,;-7.06,-1.46,;-5.52,-1.46,;-4.75,-.13,;-6.1,.59,;-6.5,-.9,;-.13,-.13,;-.61,-1.59,;.64,-2.5,;1.88,-1.59,;1.41,-.13,;3.37,-1.99,;4.46,-.9,;5.94,-1.3,;6.34,-2.79,;7.83,-3.19,;5.26,-3.87,;3.77,-3.48,)|

BDBM50593123

CC(C)(NC(=O)O[C@@H]1CN2CCC1CC2)c1csc(n1)-c1ccc(F)cc1 |r,wU:7.6,(-6.59,.2,;-5.85,-1.18,;-5.38,.09,;-4.52,-1.95,;-3.19,-1.18,;-3.19,.36,;-1.85,-1.95,;-.52,-1.18,;.81,-1.95,;2.15,-1.18,;2.15,.36,;.81,1.13,;-.52,.36,;.5,.07,;1.39,-.44,;-7.1,-2.08,;-7.1,-3.62,;-8.57,-4.1,;-9.47,-2.85,;-8.57,-1.6,;-11.01,-2.85,;-11.78,-1.52,;-13.32,-1.52,;-14.09,-2.85,;-15.63,-2.85,;-13.32,-4.18,;-11.78,-4.18,)|

BDBM50593133

CC(C)(NC(=O)O[C@@H]1CN2CCC1CC2)c1csc(n1)-c1ccc(\C=C\C(O)=O)cc1 |r,wU:7.6,(-4.96,3.4,;-4.96,1.86,;-3.63,2.63,;-6.5,1.86,;-7.27,3.19,;-6.5,4.53,;-8.81,3.19,;-9.58,1.86,;-11.12,1.86,;-11.89,.53,;-11.12,-.81,;-9.58,-.81,;-8.81,.53,;-10.16,1.24,;-10.56,-.24,;-4.19,.53,;-4.67,-.94,;-3.42,-1.84,;-2.18,-.94,;-2.65,.53,;-.69,-1.34,;.4,-.25,;1.88,-.65,;2.28,-2.13,;3.77,-2.53,;4.86,-1.44,;6.35,-1.84,;7.43,-.75,;6.74,-3.33,;1.2,-3.22,;-.29,-2.83,)|

BDBM50593132

CC(C)(NC(=O)O[C@@H]1CN2CCC1CC2)c1csc(n1)-c1ccc(cc1)C(F)(F)F |r,wU:7.6,(-1.64,3.15,;-1.64,1.61,;-.31,2.38,;-3.18,1.61,;-3.95,2.94,;-3.18,4.27,;-5.49,2.94,;-6.27,1.61,;-7.81,1.61,;-8.58,.27,;-7.81,-1.06,;-6.27,-1.06,;-5.49,.27,;-6.84,.99,;-7.24,-.5,;-.87,.27,;-1.35,-1.19,;-.1,-2.1,;1.14,-1.19,;.67,.27,;2.63,-1.59,;3.72,-.5,;5.2,-.9,;5.6,-2.39,;4.52,-3.47,;3.03,-3.08,;7.09,-2.79,;8.18,-1.7,;7.49,-4.27,;8.58,-3.19,)|

BDBM50593128

CC(C)(NC(=O)O[C@@H]1CN2CCC1CC2)c1csc(n1)-c1ccccc1 |r,wU:7.6,(-.16,2.75,;-.16,1.21,;1.18,1.98,;-1.7,1.21,;-2.47,2.54,;-1.7,3.87,;-4.01,2.54,;-4.78,1.21,;-6.32,1.21,;-7.09,-.13,;-6.32,-1.46,;-4.78,-1.46,;-4.01,-.13,;-5.36,.59,;-5.75,-.9,;.61,-.13,;.14,-1.59,;1.38,-2.5,;2.63,-1.59,;2.15,-.13,;4.12,-1.99,;5.21,-.9,;6.69,-1.3,;7.09,-2.79,;6.01,-3.87,;4.52,-3.48,)|

BDBM50593124

CC(C)(NC(=O)O[C@H]1CN2CCC1CC2)c1csc(n1)-c1ccc(F)cc1 |r,wD:7.6,(-.9,2.75,;-.9,1.21,;.43,1.98,;-2.44,1.21,;-3.21,2.54,;-2.44,3.87,;-4.75,2.54,;-5.52,1.21,;-7.06,1.21,;-7.83,-.13,;-7.06,-1.46,;-5.52,-1.46,;-4.75,-.13,;-6.1,.59,;-6.5,-.9,;-.13,-.13,;-.61,-1.59,;.64,-2.5,;1.88,-1.59,;1.41,-.13,;3.37,-1.99,;4.46,-.9,;5.94,-1.3,;6.34,-2.79,;7.83,-3.19,;5.26,-3.87,;3.77,-3.48,)|

BDBM50593125

CC(C)OC(=O)NC(C)(C)c1csc(n1)-c1ccc(F)cc1

BDBM50560053

CC1(CCCN1C(=O)Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50542796

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNCCCCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50542790

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNCCCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50542789

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNCCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50542788

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)CNCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50523489

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1CCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50523488

CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)n1cc(CN(CC[C@H](N)C(O)=O)C[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2cnc3c(N)ncnc23)nn1)C(=O)N[C@@H](C)C(N)=O |r|

BDBM50553065

CN([C@@H](CCCCN)C(N)=O)C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12 |r|

BDBM50553064

CN([C@@H](CCCNC(N)=N)C(N)=O)C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12 |r|

BDBM50560048

COc1ccc(CC(=O)N2CCC[C@H]2C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O)cc1 |r|

BDBM50560058

C[C@@H](O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(N)=O |r|

BDBM50553066

C[C@H](N(C)C(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(N)=O |r|

BDBM50560059

C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(N)=O |r|

BDBM50553058

C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(N)=O |r|

BDBM60981

C\N=c1/nc(-c2ccccc2)n(s1)-c1ccccc1

BDBM50593131

Cc1ccc(cc1)-c1nc(cs1)C(C)(C)NC(=O)O[C@@H]1CN2CCC1CC2 |r,wU:19.20,(7.83,-3.19,;6.34,-2.79,;5.95,-1.3,;4.46,-.9,;3.37,-1.99,;3.77,-3.48,;5.26,-3.87,;1.88,-1.59,;1.41,-.13,;-.13,-.13,;-.61,-1.59,;.64,-2.5,;-.9,1.21,;-.9,2.75,;.43,1.98,;-2.44,1.21,;-3.21,2.54,;-2.44,3.87,;-4.75,2.54,;-5.52,1.21,;-7.06,1.21,;-7.83,-.13,;-7.06,-1.46,;-5.52,-1.46,;-4.75,-.13,;-6.1,.59,;-6.5,-.9,)|

BDBM50593127

Cc1nc(cs1)C(C)(C)NC(=O)O[C@@H]1CN2CCC1CC2 |r,wU:13.13,(5.6,-2.68,;4.11,-2.28,;3.64,-.82,;2.1,-.82,;1.62,-2.28,;2.87,-3.19,;1.33,.52,;1.33,2.06,;2.66,1.29,;-.21,.52,;-.98,1.85,;-.21,3.19,;-2.52,1.85,;-3.29,.52,;-4.83,.52,;-5.6,-.82,;-4.83,-2.15,;-3.29,-2.15,;-2.52,-.82,;-3.87,-.1,;-4.27,-1.59,)|

BDBM50560056

NC(=N)NCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(N)=O |r|

BDBM50542794

NCCCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|

BDBM50560042

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)C1CCCC1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560043

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)C1CCCCC1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560051

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CCc1ccc(N)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560050

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CCc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50542793

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNCCCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50542792

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNCCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50542791

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50553053

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(Br)c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560049

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(CO)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50553054

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(F)c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560047

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(N)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560060

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(=O)NCC(N)=O |r|

BDBM50560066

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50553049

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560062

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(=O)N[C@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560063

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(=O)N[C@H](CCNC(N)=N)CC(N)=O |r|

BDBM50560061

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(N)=O |r|

BDBM50553057

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)NCC(N)=O |r|

BDBM50553067

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)NCc1nc2ccccc2[nH]1 |r|

BDBM50553059

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)N[C@@H](CCC(O)=O)C(N)=O |r|

BDBM50553050

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50553060

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O |r|

BDBM50553056

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)N[C@@H](Cc1c[nH]cn1)C(N)=O |r|

BDBM50553061

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(N)=O |r|

BDBM50553062

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|

BDBM50553068

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)Nc1cccc(c1)C(N)=O |r|

BDBM50553071

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)Nc1cccc2ccccc12 |r|

BDBM50553070

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)Nc1ccccc1 |r|

BDBM50553069

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(=O)Nc1ccccc1C(N)=O |r|

BDBM50553063

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(N)=O |r|

BDBM50553051

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2cccnc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50553052

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ncccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560046

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50523491

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1CCCN(CC[C@H](N)C(O)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560045

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccccc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560044

NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)c1ccco1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560052

NCCCC[C@H](NC(=O)[C@@H]1CCCN1CCc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560057

NCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(N)=O |r|

BDBM50553055

NCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1cccc2ccccc12)C(N)=O |r|

BDBM50560065

NCCCC[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560054

NCCCC[C@H](NC(=O)c1cccc(NC(=O)Cc2ccc(O)cc2)c1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560055

NCCCC[C@H](NC(=O)c1ccccc1NC(=O)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|

BDBM50560064

NCCC[C@H](CC(=O)N[C@@H](CCCNC(N)=N)C(N)=O)NC(=O)[C@@H]1CCCN1C(=O)Cc1ccc(O)cc1 |r|

BDBM50506000

N[C@@H](CCN(CC#Cc1cccc(c1)C(N)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|

BDBM50523490

N[C@@H](CCN(CCCN1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(N)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|

BDBM50523492

N[C@@H](CCN(CCCNCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(N)=O)C[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|

BDBM50542795

N[C@@H](CCNC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12)C(O)=O |r|