UCSF

ZINC08738641

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2007 34 No

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

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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) 2.98 9.53 -66.23 0 9 -1 114 463.466 8 ↓
Mid Mid (pH 6-8) 2.40 2.14 -14.05 0 9 0 108 464.474 8 ↓
Lo Low (pH 4.5-6) 2.98 8.71 -22.23 1 9 0 111 464.474 8 ↓

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