UCSF

ZINC08856316

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 30th, 2007 32 No

Popular Name: 4-[(4-ethoxyphenyl)-hydroxy-methylene]-5-(4-methoxyphenyl)-1-(5-methylisoxazol-3-yl)-pyrrolidine-2,3 4-[(4-ethoxyphenyl)-hydroxy-meth…

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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) 3.39 9.59 -66.08 0 8 -1 105 433.44 7 ↓
Mid Mid (pH 6-8) 2.81 1.75 -16.26 0 8 0 98 434.448 7 ↓
Lo Low (pH 4.5-6) 3.39 8.77 -20.71 1 8 0 102 434.448 7 ↓

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