UCSF

ZINC34941361

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 34 No

Popular Name: (4E,5S)-4-[(3-butoxyphenyl)-hydroxy-methylene]-1-(2-morpholinoethyl)-5-(4-pyridyl)pyrrolidine-2,3-di (4E,5S)-4-[(3-butoxyphenyl)-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) 2.44 6.96 -59.54 0 8 -1 95 464.542 10 ↓
Mid Mid (pH 6-8) 2.44 9.23 -76.76 1 8 0 96 465.55 10 ↓
Lo Low (pH 4.5-6) 2.44 8.47 -60.39 2 8 1 93 466.558 10 ↓

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