UCSF

ZINC08440874

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 15th, 2006 32 No

Popular Name: 1-(2-furylmethyl)-3-hydroxy-4-(4-methylbenzoyl)-5-(4-propoxyphenyl)-1,5-dihydro-2H-pyrrol-2-one 1-(2-furylmethyl)-3-hydroxy-4-(4…

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Other Names:

MFCD03213640

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) 4.42 12.1 -58.63 0 6 -1 83 430.48 8 ↓
Mid Mid (pH 6-8) 4.86 1.37 -29.72 1 6 0 79 431.488 7 ↓
Mid Mid (pH 6-8) 3.83 1.58 -20.02 0 6 0 76 431.488 8 ↓

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