UCSF

ZINC33724106

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Substance Information

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

Popular Name: (4E,5S)-4-[(3-butoxyphenyl)-hydroxy-methylene]-5-(3-chlorophenyl)-1-[3-(diethylamino)propyl]pyrrolid (4E,5S)-4-[(3-butoxyphenyl)-hydr…

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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) 5.56 14.42 -50.85 1 6 0 74 499.051 13 ↓
Lo Low (pH 4.5-6) 5.56 13.29 -47.28 2 6 1 71 500.059 13 ↓

Activity (Go SEA)

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