UCSF

ZINC33764840

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 30 No

Popular Name: (4Z,5S)-1-(2-diethylaminoethyl)-5-(4-ethylphenyl)-4-[hydroxy(4-pyridyl)methylene]pyrrolidine-2,3-dio (4Z,5S)-1-(2-diethylaminoethyl)-…

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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) 2.79 11.44 -65.87 1 6 0 78 407.514 9 ↓
Hi High (pH 8-9.5) 2.79 9.09 -51.07 0 6 -1 77 406.506 9 ↓
Lo Low (pH 4.5-6) 2.79 10.14 -55.24 2 6 1 75 408.522 9 ↓

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