UCSF

ZINC39898708

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 14th, 2010 33 Yes

Popular Name: (4S,6aS)-5-allyl-3-(5-chloro-2-hydroxy-phenyl)-4-(4-hexoxyphenyl)-4,6a-dihydropyrrolo[3,4-c]pyrazol- (4S,6aS)-5-allyl-3-(5-chloro-2-h…

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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) 6.55 10.93 -9.93 2 6 0 78 465.981 10 ↓
Mid Mid (pH 6-8) 6.55 11.69 -45.13 1 6 -1 81 464.973 10 ↓

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