UCSF

ZINC17251028

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2008 31 No

Popular Name: (4E,5R)-4-[hydroxy-(4-isopropoxyphenyl)methylene]-1-(2-methoxyethyl)-5-(2-methoxyphenyl)pyrrolidine- (4E,5R)-4-[hydroxy-(4-isopropoxy…

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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) 3.17 7.45 -64.34 0 7 -1 88 424.473 9 ↓
Mid Mid (pH 6-8) 3.17 9.52 -11.24 1 7 0 85 425.481 9 ↓
Mid Mid (pH 6-8) 2.58 9.86 -10.42 0 7 0 82 425.481 9 ↓

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