UCSF

ZINC16731638

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2008 39 No

Popular Name: (5S)-5-(4-butoxyphenyl)-3-hydroxy-1-(2-methoxyethyl)-4-[4-(p-tolylmethoxy)benzoyl]-5H-pyrrol-2-one (5S)-5-(4-butoxyphenyl)-3-hydrox…

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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) 5.96 12.32 -15.63 1 7 0 85 529.633 13 ↓
Mid Mid (pH 6-8) 5.37 12.99 -22.22 0 7 0 82 529.633 13 ↓

Activity (Go SEA)

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