UCSF

ZINC00401417

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 24th, 2004 10 Yes

Popular Name: (4S,6R)-4,6-dimethylcyclohexane-1,3-quinone (4S,6R)-4,6-dimethylcyclohexane-…

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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) 0.55 3.27 -9.08 0 2 0 34 140.182 0 ↓
Mid Mid (pH 6-8) 1.29 4.26 -42.71 0 2 -1 40 139.174 0 ↓
Mid Mid (pH 6-8) 1.29 3.23 -44.81 0 2 -1 40 139.174 0 ↓
Mid Mid (pH 6-8) 1.29 2.45 -8.55 1 2 0 37 140.182 0 ↓
Mid Mid (pH 6-8) 1.29 2.45 -8.55 1 2 0 37 140.182 0 ↓

Activity (Go SEA)

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