UCSF

ZINC34930705

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 1st, 2009 37 No

Popular Name: (4Z,5S)-5-(3-butoxyphenyl)-4-[hydroxy-(4-propoxyphenyl)methylene]-1-(4-pyridylmethyl)pyrrolidine-2,3 (4Z,5S)-5-(3-butoxyphenyl)-4-[hy…

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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) 4.89 12.63 -57.19 0 7 -1 92 499.587 12 ↓
Lo Low (pH 4.5-6) 4.89 11.88 -13.29 1 7 0 89 500.595 12 ↓
Lo Low (pH 4.5-6) 4.89 12.34 -47.75 2 7 1 90 501.603 12 ↓

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