UCSF

ZINC34943027

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 37 No

Popular Name: (4E,5S)-5-(4-benzyloxyphenyl)-1-[3-(dimethylamino)propyl]-4-[(2,5-dimethylphenyl)-hydroxy-methylene] (4E,5S)-5-(4-benzyloxyphenyl)-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) 5.16 15.73 -80.57 1 6 0 74 498.623 10 ↓
Lo Low (pH 4.5-6) 5.16 14.84 -51.05 2 6 1 71 499.631 10 ↓

Activity (Go SEA)

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