Submission Details
Molecule(s):
O=C(CN1CCNCC1)NCCc1c[nH]c2ccc(F)cc12
CC(=O)NCCc1c[nH]c2c(CN3CCNCC3)cc(F)cc12
CC(NC1COCC1O)C(=O)NCCc1c[nH]c2ccc(F)cc12
CC(=O)NCCc1c[nH]c2c(CN3CCOCC3)cc(F)cc12
CC(=O)NCCc1c[nH]c2c(C(C)NC3COCC3O)cc(F)cc12
CC(=O)NCCc1c[nH]c2c(N3CCNCC3)cc(F)cc12
O=C(CN1CCOCC1)NCCc1c[nH]c2ccc(F)cc12
O=C(O)CC(=O)NCCc1c[nH]c2ccc(F)cc12
CC(=O)NCCc1c[nH]c2c(C(=O)O)cc(F)cc12
Design Rationale:
SeeSAR 9.2 Inspirator, 9 best molecules after fragment growing in a binding site, x0104