UCSF

ZINC40052722

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 22nd, 2010 32 No

Popular Name: (2S)-2-(2-bromophenyl)-4-hydroxy-1-(3-hydroxypropyl)-3-(4-isobutoxy-3-methyl-benzoyl)-2H-pyrrol-5-on (2S)-2-(2-bromophenyl)-4-hydroxy…

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Vendors

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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) 4.33 9.01 -54.28 1 6 -1 90 501.397 9 ↓
Lo Low (pH 4.5-6) 4.33 8.26 -11.81 2 6 0 87 502.405 9 ↓

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