UCSF

ZINC09273999

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 16th, 2007 36 No

Popular Name: 4-[(4-allyloxyphenyl)-hydroxy-methylene]-1-(2-morpholinoethyl)-5-(4-nitrophenyl)-pyrrolidine-2,3-dio 4-[(4-allyloxyphenyl)-hydroxy-me…

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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) 2.91 8.62 -54.3 0 10 -1 128 492.508 10 ↓
Mid Mid (pH 6-8) 3.36 11.11 -57.01 2 10 1 126 494.524 9 ↓
Mid Mid (pH 6-8) 2.91 10.95 -75.31 1 10 0 129 493.516 10 ↓

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