UCSF

ZINC17146163

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 16th, 2008 26 No

Popular Name: (4Z,5S)-4-[(4-chlorophenyl)-hydroxy-methylene]-1-methyl-5-(3-nitrophenyl)pyrrolidine-2,3-dione (4Z,5S)-4-[(4-chlorophenyl)-hydr…

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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) 2.99 8.68 -50.19 0 7 -1 106 371.756 4 ↓
Mid Mid (pH 6-8) 2.41 9.43 -20.56 0 7 0 100 372.764 4 ↓
Mid Mid (pH 6-8) 2.99 8.75 -13.14 1 7 0 103 372.764 4 ↓

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