UCSF

ZINC01451992

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2004 33 No

Popular Name: (5S)-5-(4-chlorophenyl)-1-(6-ethyl-1,3-benzothiazol-2-yl)-2-keto-4-(5-methyl-2-furoyl)-3-pyrrolin-3- (5S)-5-(4-chlorophenyl)-1-(6-eth…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 5.68 12.55 -55.25 0 6 -1 86 477.949 5 ↓
Mid Mid (pH 6-8) 6.13 11.59 -27.8 1 6 0 84 478.957 4 ↓
Mid Mid (pH 6-8) 5.10 12.6 -14.39 0 6 0 80 478.957 5 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )