UCSF

ZINC20219580

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 29 No

Popular Name: (5S)-5-(3,4-dichlorophenyl)-1-(3-dimethylaminopropyl)-3-hydroxy-4-(pyridine-4-carbonyl)-5H-pyrrol-2- (5S)-5-(3,4-dichlorophenyl)-1-(3…

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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) 2.67 9.49 -66.76 1 6 0 78 434.323 7 ↓
Lo Low (pH 4.5-6) 2.67 8.67 -49.67 2 6 1 75 435.331 7 ↓

Activity (Go SEA)

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