UCSF

ZINC39914849

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 16th, 2010 37 Yes

Popular Name: (4S,6aS)-4-(3-butoxyphenyl)-3-(5-chloro-2-hydroxy-4-methyl-phenyl)-5-[(4-fluorophenyl)methyl]-4,6a-d (4S,6aS)-4-(3-butoxyphenyl)-3-(5…

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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) 6.81 12.48 -10.39 2 6 0 78 520.004 8 ↓
Mid Mid (pH 6-8) 6.81 13.25 -47.26 1 6 -1 81 518.996 8 ↓

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