UCSF

ZINC39848094

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2010 33 No

Popular Name: (2S)-2-(3-fluorophenyl)-4-hydroxy-3-(2-methoxybenzoyl)-1-(3-morpholinopropyl)-2H-pyrrol-5-one (2S)-2-(3-fluorophenyl)-4-hydrox…

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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) 2.67 7.93 -62.87 0 7 -1 82 453.49 8 ↓
Mid Mid (pH 6-8) 2.67 10.2 -76.77 1 7 0 83 454.498 8 ↓
Lo Low (pH 4.5-6) 2.67 9.46 -51.46 2 7 1 81 455.506 8 ↓

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