UCSF

ZINC40099309

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 23rd, 2010 34 No

Popular Name: (2S)-3-(4-allyloxybenzoyl)-4-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-2-(3-nitrophenyl)-2H-pyrrol-5-one (2S)-3-(4-allyloxybenzoyl)-4-hyd…

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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) 2.27 6.44 -67.52 1 10 -1 145 467.454 12 ↓
Lo Low (pH 4.5-6) 2.27 5.7 -21.43 2 10 0 142 468.462 12 ↓

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