UCSF

ZINC00702742

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 36 No

Popular Name: 5-[4-(benzyloxy)phenyl]-4-(4-chlorobenzoyl)-3-hydroxy-1-(tetrahydro-2-furanylmethyl)-1,5-dihydro-2H-pyrrol-2-one 5-[4-(benzyloxy)phenyl]-4-(4-chl…

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Other Names:

MFCD03213711

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) 5.08 13.78 -54.41 0 6 -1 79 502.974 8 ↓
Mid Mid (pH 6-8) 5.53 -1.37 -31.26 1 6 0 76 503.982 7 ↓
Mid Mid (pH 6-8) 4.50 -1.14 -21.52 0 6 0 72 503.982 8 ↓

Activity (Go SEA)

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