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TC490
Cc1cc(C)c2c(c1C)O[C@](C)(c1cn(CCc3cc(O)cc(O)c3)nn1)CN2
Formula: C22H26N4O3
MW: 394.48 | LogP: 3.58
TPSA: 92.43
Patterns:
TC343
Cc1c(C)c(-c2cccc(O)c2)c(C)c2c1O[C@](C)(c1cn(CCc3ccc(O)c(O)c3)nn1)CN2
Formula: C28H30N4O4
MW: 486.57 | LogP: 4.95
TPSA: 112.66
Patterns:
Z19223403
O=C1COc2ccc(C(=O)CSc3nnc(-c4ccccc4)c(-c4ccccc4)n3)cc2N1
Formula: C25H18N4O3S
MW: 454.51 | LogP: 4.51
TPSA: 94.07
Patterns:
TC322
Cc1cc(C)c2c(c1C)O[C@](C)(COCC(=O)CC(=[NH2+])CCc1ccc(O)c(O)c1)CN2
Formula: C25H33N2O5+
MW: 441.55 | LogP: 2.39
TPSA: 113.61
Patterns:
TC344
COc1ccc(CCC(=[NH2+])CC(=O)COC[C@]2(C)CNc3c(C)cc(C)c(C)c3O2)cc1OC
Formula: C27H37N2O5+
MW: 469.60 | LogP: 3.00
TPSA: 91.61
Patterns:
Z114950188
O=C1COc2ccc(C(=O)/C=C\c3ccccc3)cc2N1
Formula: C17H13NO3
MW: 279.30 | LogP: 2.91
TPSA: 55.40
Patterns:
Z19836421
O=C1COc2ccc(C(=O)COC(=O)/C=C\c3ccc(Br)o3)cc2N1
Formula: C17H12BrNO6
MW: 406.19 | LogP: 2.81
TPSA: 94.84
Patterns:
Z19836421
O=C1COc2ccc(C(=O)COC(=O)/C=C/c3ccc(Br)o3)cc2N1
Formula: C17H12BrNO6
MW: 406.19 | LogP: 2.81
TPSA: 94.84
Patterns:
TC288
Cc1cc(C)c2c(c1C)O[C@@](C)(c1cn(CCc3ccc(O)c(O)c3)nn1)CN2
Formula: C22H26N4O3
MW: 394.48 | LogP: 3.58
TPSA: 92.43
Patterns:
TC342
Cc1c(C)c(-c2cccc(O)c2)c(C)c2c1O[C@@](C)(COCc1cn(CCc3ccc(O)c(O)c3)nn1)CN2
Formula: C30H34N4O5
MW: 530.63 | LogP: 5.01
TPSA: 121.89
Patterns:
TC288
Cc1cc(C)c2c(c1C)O[C@](C)(c1cn(CCc3ccc(O)c(O)c3)nn1)CN2
Formula: C22H26N4O3
MW: 394.48 | LogP: 3.58
TPSA: 92.43
Patterns:
TC322
[H]/N=C(/CCc1ccc(O)c(O)c1)CC(=O)COC[C@@]1(C)CNc2c(C)cc(C)c(C)c2O1
Formula: C25H32N2O5
MW: 440.54 | LogP: 4.21
TPSA: 111.87
Patterns:
Z56838445
COc1ccccc1/N=c1\scc(-c2ccc3c(c2)NC(=O)CO3)n1C[C@@H]1CCCO1
Formula: C23H23N3O4S
MW: 437.52 | LogP: 3.97
TPSA: 74.08
Patterns:
TC342
Cc1c(C)c(-c2cccc(O)c2)c(C)c2c1O[C@](C)(COCc1cn(CCc3ccc(O)c(O)c3)nn1)CN2
Formula: C30H34N4O5
MW: 530.63 | LogP: 5.01
TPSA: 121.89
Patterns:
TC131
Cc1c(C)c(-c2cccc(O)c2)c(C)c2c1O[C@H](c1ccccc1)CN2
Formula: C23H23NO2
MW: 345.44 | LogP: 5.53
TPSA: 41.49
Patterns: