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90 SMILES Strings for BACE-1

Compound NameSMILES String
BDBM228032 CN1C(=N)N[C@]2(CO[C@H](CC2C1=O)C1CC1)c1cc(Oc2ncncc2F)ccc1F |r|
BDBM228033 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc(F)cnc2F)c(F)cc1F |r|
BDBM228034 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ncc(C)cc2F)ccc1F |r|
BDBM228038 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cnccn2)ccc1F |r|
BDBM228035 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C(F)F)c1cc(Oc2ncc(F)cc2F)ccc1F |r|
BDBM228036 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(O)ccc1F |r|
BDBM228037 COc1cncc(Oc2ccc(F)c(c2)[C@]23CO[C@@H](C)C[C@H]2C(=O)N(C)C(=N)N3)n1 |r|
BDBM228039 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cncc(C)n2)ccc1F |r|
BDBM228040 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ccc(F)cn2)ccc1F |r|
BDBM228041 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncncc2F)ccc1F |r|
BDBM228042 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2nccnc2C)ccc1F |r|
BDBM228043 COc1ccnc(Oc2ccc(F)c(c2)[C@]23CO[C@@H](C)C[C@H]2C(=O)N(C)C(=N)N3)c1 |r|
BDBM228013 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ccnnc2)ccc1F |r|
BDBM228012 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ccncc2)ccc1F |r|
BDBM228014 COc1cncc(Oc2ccc(F)c(c2)[C@]23CO[C@H](C[C@H]2C(=O)N(C)C(=N)N3)C2CC2)n1 |r|
BDBM228015 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ncccn2)ccc1F |r|
BDBM228017 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OCC2CCC2)ccc1F |r|
BDBM228019 CC(C)COc1ccc(F)c(c1)[C@]12CO[C@H](C[C@H]1C(=O)N(C)C(=N)N2)C1CC1 |r|
BDBM228020 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OCC(F)F)ccc1F |r|
BDBM228021 COC[C@@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1ccc(F)cc1F |r|
BDBM228022 COC(=O)[C@@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1ccc(F)cc1F |r|
BDBM228023 CCCOc1ccc(F)c(c1)[C@]12CO[C@H](C[C@H]1C(=O)N(C)C(=N)N2)C1CC1 |r|
BDBM228024 COCCOc1ccc(F)c(c1)[C@]12CO[C@H](C[C@H]1C(=O)N(C)C(=N)N2)C1CC1 |r|
BDBM228025 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OCC2CC(F)(F)C2)ccc1F |r|
BDBM228026 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OCC2CC2(F)F)ccc1F |r|
BDBM228027 COC1CC(COc2ccc(F)c(c2)[C@]23CO[C@H](C[C@H]2C(=O)N(C)C(=N)N3)C2CC2)C1 |r,wU:14.14,wD:19.19,17.29,(-7.86,6.38,;-6.32,6.38,;-5.55,5.05,;-4.06,4.65,;-4.46,3.16,;-3.69,1.83,;-2.15,1.83,;-1.38,.49,;-2.15,-.84,;-1.38,-2.17,;.16,-2.17,;.93,-3.51,;.93,-.84,;.16,.49,;2.47,-.84,;1.7,-2.17,;2.47,-3.51,;4.01,-3.51,;4.78,-2.17,;4.01,-.84,;4.78,.49,;6.32,.49,;4.01,1.83,;4.78,3.16,;2.47,1.83,;1.7,3.16,;1.7,.49,;4.78,-4.84,;4.78,-6.38,;6.11,-5.61,;-5.95,3.56,)|
BDBM228028 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OCC23CC(C2)C3)ccc1F |r|
BDBM228029 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OCC(F)(F)F)ccc1F |r|
BDBM228030 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cc(ccn2)-n2cccn2)ccc1F |r|
BDBM227995 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(OCC23CC(C2)(C3)C#N)ccc1F |r|
BDBM227996 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cncc(c2)C#N)ccc1F |r|
BDBM227997 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(ccc1F)-c1cncnc1 |r|
BDBM227999 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cncc(n2)C(F)F)ccc1F |r|
BDBM228000 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc(ccn2)C#N)ccc1F |r|
BDBM228001 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncccc2F)ccc1F |r|
BDBM227968 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1ccc(F)cc1F |r|
BDBM227969 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc(ccn2)C#N)c(F)cc1F |r|
BDBM227970 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncccc2F)c(F)cc1F |r|
BDBM227971 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc(OC)ccn2)c(F)cc1F |r|
BDBM227972 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(OCC2CC2)c(F)cc1F |r|
BDBM227976 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)c1cc(C)no1)c1cc(F)ccc1F |r|
BDBM227977 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc(ccn2)C#N)c(F)cc1F |r|
BDBM227974 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1ccc(F)cc1F |r|
BDBM227975 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C(F)F)c1ccc(F)cc1F |r|
BDBM227978 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncccc2F)c(F)cc1F |r|
BDBM227979 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1ccc(F)cc1F |r|
BDBM227980 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Br)ccc1F |r|
BDBM227981 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cc(ncn2)-n2cccn2)ccc1F |r|
BDBM227984 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ccnc(c2)-n2cncn2)ccc1F |r|
BDBM227985 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cncc(C)n2)ccc1F |r|
BDBM227982 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cc(ccn2)C#N)ccc1F |r|
BDBM227983 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ncccc2F)ccc1F |r|
BDBM227986 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ncc(F)cc2F)ccc1F |r|
BDBM227987 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncccc2F)ccc1F |r|
BDBM227988 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ccnc(c2)C(F)F)ccc1F |r|
BDBM227993 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OCC2CC2)ccc1F |r|
BDBM227989 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc(ccn2)C#N)ccc1F |r|
BDBM227990 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2ccnc(C)n2)ccc1F |r|
BDBM227994 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cccc(c2)C#N)ccc1F |r|
BDBM228007 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cccc(c2)-c2cocn2)ccc1F |r|
BDBM228006 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cccc(n2)-n2cccn2)ccc1F |r|
BDBM228009 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OCC23CC(C2)(C3)C#N)ccc1F |r|
BDBM228010 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(ccc1F)C#N |r|
BDBM228011 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(Oc2cnccn2)ccc1F |r|
BDBM228002 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(OCC2CC2)ccc1F |r|
BDBM228003 COC[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Br)ccc1F |r|
BDBM227991 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(OCC2CC2)ccc1F |r|
BDBM228008 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncc(F)cc2F)ccc1F |r|
BDBM228031 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)C1CC1)c1cc(OC2CC(F)(F)C2)ccc1F |r|
BDBM228044 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncccc2Cl)ccc1F |r|
BDBM228045 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncccc2C)ccc1F |r|
BDBM228046 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ccncc2F)ccc1F |r|
BDBM228047 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cnccc2Cl)ccc1F |r|
BDBM228048 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ccccn2)ccc1F |r|
BDBM228049 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc3ccccc3cn2)ccc1F |r|
BDBM228050 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cncc(F)c2)ccc1F |r|
BDBM228052 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc(F)cnc2F)ccc1F |r|
BDBM228053 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cccnc2)ccc1F |r|
BDBM228054 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2cc(F)ccc2F)ccc1F |r|
BDBM228055 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)c1ccc(F)cc1)c1cc(Br)ccc1F |r|
BDBM228056 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)c1ccc(F)cc1)c1cc(O)ccc1F |r|
BDBM228057 CN1C(=N)N[C@]2(CO[C@H](C[C@H]2C1=O)c1ccc(F)cc1)c1cc(OCC2CC2)ccc1F |r|
BDBM228058 CN1C(=N)N[C@]2(COCC[C@H]2C1=O)c1cc(Br)ccc1F |r|
BDBM228059 CN1C(=N)N[C@]2(COCC[C@H]2C1=O)c1cc(Oc2ncccc2F)ccc1F |r|
BDBM228060 CN1C(=N)N[C@]2(COCC[C@H]2C1=O)c1cc(OCC2CC2)ccc1F |r|
BDBM228063 COc1cc(c(F)cn1)[C@]12CO[C@@H](C)C[C@H]1C(=O)N(C)C(=N)N2 |r|
BDBM228065 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(OCCC=C)ncc1F |r|
BDBM228066 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(=O)n(CC2CC2)cc1F |r|
BDBM228067 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(=O)n(CCC=C)cc1F |r|
BDBM228068 C[C@H]1C[C@H]2C(=O)N(C)C(=N)N[C@]2(CO1)c1cc(Oc2ncccc2F)ncc1F |r|