UCSF

ZINC39898600

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 36 Yes

Popular Name: (4S,6aS)-4-(4-butoxy-3-ethoxy-phenyl)-3-(5-chloro-2-hydroxy-phenyl)-5-pentyl-4,6a-dihydropyrrolo[3,4 (4S,6aS)-4-(4-butoxy-3-ethoxy-ph…

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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) 6.80 11.68 -12.74 2 7 0 88 512.05 12 ↓
Mid Mid (pH 6-8) 6.80 11.88 -12.94 2 7 0 88 512.05 12 ↓

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