UCSF

ZINC09360694

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2007 31 No

Popular Name: 4-[(4-allyloxyphenyl)-hydroxy-methylene]-5-(4-hydroxyphenyl)-1-(3-methoxypropyl)pyrrolidine-2,3-dion 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) 2.86 6.32 -61.27 1 7 -1 99 422.457 10 ↓
Mid Mid (pH 6-8) 2.27 -1.51 -13.64 1 7 0 93 423.465 10 ↓
Lo Low (pH 4.5-6) 2.86 5.51 -17.89 2 7 0 96 423.465 10 ↓

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