UCSF

ZINC39898568

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 34 Yes

Popular Name: (4S,6aS)-3-(5-chloro-2-hydroxy-phenyl)-4-(4-pentoxyphenyl)-5-pentyl-4,6a-dihydropyrrolo[3,4-c]pyrazo (4S,6aS)-3-(5-chloro-2-hydroxy-p…

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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) 7.34 12.6 -35.48 1 6 -1 81 481.016 11 ↓
Mid Mid (pH 6-8) 7.34 11.84 -12.43 2 6 0 78 482.024 11 ↓
Mid Mid (pH 6-8) 7.34 11.64 -10.31 2 6 0 78 482.024 11 ↓

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