UCSF

ZINC06668084

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 13th, 2006 29 No

Popular Name: 5-(2-furyl)-3-hydroxy-1-(3-isopropoxypropyl)-4-(3-methoxybenzoyl)-1,5-dihydro-2H-pyrrol-2-one 5-(2-furyl)-3-hydroxy-1-(3-isopr…

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Other Names:

MFCD07800925

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) 2.66 7.41 -45.2 0 7 -1 92 398.435 9 ↓
Mid Mid (pH 6-8) 3.11 6.02 -28.63 1 7 0 89 399.443 8 ↓
Mid Mid (pH 6-8) 2.08 7.07 -21.49 0 7 0 86 399.443 9 ↓

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