UCSF

ZINC09436783

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 27th, 2007 33 No

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

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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) 3.39 9.83 -55.79 0 9 -1 125 453.471 10 ↓
Mid Mid (pH 6-8) 3.83 10.17 -16.76 1 9 0 122 454.479 9 ↓
Mid Mid (pH 6-8) 2.80 10.15 -15.71 0 9 0 119 454.479 10 ↓

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