UCSF

ZINC00702763

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2004 34 No

Popular Name: 5-(4-tert-butylphenyl)-4-(4-ethoxybenzoyl)-1-(2-furylmethyl)-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one 5-(4-tert-butylphenyl)-4-(4-etho…

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Other Names:

MFCD03213530

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) 5.17 12.61 -42.59 0 6 -1 83 458.534 8 ↓
Mid Mid (pH 6-8) 5.62 1.94 -26.67 1 6 0 79 459.542 7 ↓
Mid Mid (pH 6-8) 4.59 2.17 -17.45 0 6 0 76 459.542 8 ↓

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