UCSF

ZINC33775444

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 18th, 2009 39 No

Popular Name: (4Z,5S)-5-(4-benzyloxy-3-methoxy-phenyl)-4-[hydroxy(4-pyridyl)methylene]-1-(2-morpholinoethyl)pyrrol (4Z,5S)-5-(4-benzyloxy-3-methoxy…

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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) 2.21 9.01 -55.13 0 9 -1 104 528.585 10 ↓
Mid Mid (pH 6-8) 2.21 11.34 -69.61 1 9 0 105 529.593 10 ↓
Lo Low (pH 4.5-6) 2.21 10.04 -62.43 2 9 1 103 530.601 10 ↓

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