UCSF

ZINC38152183

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 5th, 2010 38 No

Popular Name: (2R)-1-(2-diethylaminoethyl)-4-hydroxy-3-(4-morpholinosulfonylbenzoyl)-2-(p-tolyl)-2H-pyrrol-5-one (2R)-1-(2-diethylaminoethyl)-4-h…

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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) 2.77 9.53 -68.92 1 9 0 111 541.67 10 ↓
Hi High (pH 8-9.5) 2.77 7.26 -58.8 0 9 -1 110 540.662 10 ↓
Lo Low (pH 4.5-6) 2.77 8.76 -53.72 2 9 1 109 542.678 10 ↓

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