UCSF

ZINC16212887

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 24th, 2008 31 No

Popular Name: (5R)-5-(4-butoxy-3-methoxy-phenyl)-4-(furan-2-carbonyl)-3-hydroxy-1-(2-methoxyethyl)-5H-pyrrol-2-one (5R)-5-(4-butoxy-3-methoxy-pheny…

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Download: MOL2 SDF SMILES Flexibase

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) 2.70 6.84 -19.23 1 8 0 98 429.469 11 ↓
Mid Mid (pH 6-8) 2.12 7.68 -28.53 0 8 0 95 429.469 11 ↓

Activity (Go SEA)

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