UCSF

ZINC12969987

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 23rd, 2008 31 No

Popular Name: (4Z,5R)-1-(3-dimethylaminopropyl)-4-[hydroxy-(4-isopropoxyphenyl)methylene]-5-(3-pyridyl)pyrrolidine (4Z,5R)-1-(3-dimethylaminopropyl…

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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) 2.24 9.26 -72.37 1 7 0 87 423.513 9 ↓
Lo Low (pH 4.5-6) 1.65 10.67 -118.2 2 7 2 82 425.529 9 ↓
Lo Low (pH 4.5-6) 2.24 8.44 -46.82 2 7 1 84 424.521 9 ↓

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