UCSF

ZINC39899291

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Substance Information

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

Popular Name: (4R,6aS)-4-(4-tert-butylphenyl)-3-(5-chloro-2-hydroxy-phenyl)-5-(3-isopropoxypropyl)-4,6a-dihydropyr (4R,6aS)-4-(4-tert-butylphenyl)-…

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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) 6.10 11 -10.04 2 6 0 78 482.024 8 ↓
Mid Mid (pH 6-8) 6.10 11.13 -13.02 2 6 0 78 482.024 8 ↓

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