UCSF

ZINC02771859

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 35 No

Popular Name: (4R,7R)-4-(3-chloro-5-ethoxy-4-hydroxy-phenyl)-5-keto-2-methyl-7-phenyl-4,6,7,8-tetrahydro-1H-quinol (4R,7R)-4-(3-chloro-5-ethoxy-4-h…

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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) 6.46 12.98 -20.09 2 6 0 85 496.003 8 ↓
Mid Mid (pH 6-8) 6.46 13.77 -65.14 1 6 -1 88 494.995 8 ↓

Activity (Go SEA)

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