UCSF

ZINC09068033

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 7th, 2007 35 No

Popular Name: 4-[(4-butoxy-3-methyl-phenyl)-hydroxy-methylene]-1-(3-morpholinopropyl)-5-(2-thienyl)pyrrolidine-2,3 4-[(4-butoxy-3-methyl-phenyl)-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) 4.30 9.09 -58.57 0 7 -1 82 497.637 11 ↓
Mid Mid (pH 6-8) 3.71 -1.31 -46.87 1 7 1 77 499.653 11 ↓
Mid Mid (pH 6-8) 4.30 11.43 -77.77 1 7 0 83 498.645 11 ↓

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