UCSF

ZINC33723532

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 16th, 2009 35 No

Popular Name: (4E,5R)-5-(3,4-dichlorophenyl)-1-[3-(diethylamino)propyl]-4-[hydroxy-(3-propoxyphenyl)methylene]pyrr (4E,5R)-5-(3,4-dichlorophenyl)-1…

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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) 5.63 14.23 -50.88 1 6 0 74 519.469 12 ↓
Lo Low (pH 4.5-6) 5.63 13.09 -51.52 2 6 1 71 520.477 12 ↓

Activity (Go SEA)

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