UCSF

ZINC33774815

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 36 No

Popular Name: (4Z,5R)-5-(4-butoxy-3-methoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-(2-morpholinoethyl)pyrrolidi (4Z,5R)-5-(4-butoxy-3-methoxy-ph…

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Download: MOL2 SDF SMILES Flexibase

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) 2.05 7.71 -52.72 0 9 -1 104 494.568 11 ↓
Mid Mid (pH 6-8) 2.05 10.06 -71.08 1 9 0 105 495.576 11 ↓
Lo Low (pH 4.5-6) 2.05 8.76 -64.42 2 9 1 103 496.584 11 ↓

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