UCSF

ZINC39827898

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 9th, 2010 36 No

Popular Name: (2R)-1-(2-diethylaminoethyl)-4-hydroxy-3-(4-isobutoxybenzoyl)-2-(3-nitrophenyl)-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) 4.27 13.71 -66.17 1 9 0 120 495.576 12 ↓
Lo Low (pH 4.5-6) 4.27 12.96 -54.14 2 9 1 117 496.584 12 ↓

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