UCSF

ZINC39898052

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 31 Yes

Popular Name: (4S,6aS)-3-(5-chloro-2-hydroxy-phenyl)-4-(3-ethoxy-4-hydroxy-phenyl)-5-(3-hydroxypropyl)-4,6a-dihydr (4S,6aS)-3-(5-chloro-2-hydroxy-p…

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Annotations

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Vendors

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) 2.75 2.47 -14.37 4 8 0 119 443.887 7 ↓
Mid Mid (pH 6-8) 2.75 2.82 -15.79 4 8 0 119 443.887 7 ↓

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