UCSF

ZINC20229764

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 18th, 2008 32 No

Popular Name: (5R)-5-(2,5-dimethoxyphenyl)-1-(3-dimethylaminopropyl)-4-(4-fluorobenzoyl)-3-hydroxy-5H-pyrrol-2-one (5R)-5-(2,5-dimethoxyphenyl)-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) 2.88 9.52 -75.82 1 7 0 83 442.487 9 ↓
Lo Low (pH 4.5-6) 2.88 8.7 -50.87 2 7 1 81 443.495 9 ↓

Activity (Go SEA)

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