UCSF

ZINC19883435

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2008 33 No

Popular Name: (5R)-4-(4-fluorobenzoyl)-3-hydroxy-5-(4-isopropylphenyl)-1-(2-morpholinoethyl)-5H-pyrrol-2-one (5R)-4-(4-fluorobenzoyl)-3-hydro…

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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) 3.93 8.57 -56.6 0 6 -1 73 451.518 7 ↓
Mid Mid (pH 6-8) 3.93 10.91 -67.79 1 6 0 74 452.526 7 ↓
Lo Low (pH 4.5-6) 3.93 10.09 -50.62 2 6 1 71 453.534 7 ↓

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