UCSF

ZINC08433395

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 37 No

Popular Name: 4-(4-butoxy-2-methylbenzoyl)-3-hydroxy-5-(4-methylphenyl)-1-(3-morpholin-4-ylpropyl)-1,5-dihydro-2H-pyrrol-2-one 4-(4-butoxy-2-methylbenzoyl)-3-h…

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Other Names:

MFCD03299161

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

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) 4.84 0.44 -49.92 2 7 1 80 507.651 11 ↓
Mid Mid (pH 6-8) 5.29 0.05 -62.64 2 7 1 80 507.651 10 ↓
Mid Mid (pH 6-8) 4.26 0.27 -59.43 1 7 1 77 507.651 11 ↓

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