UCSF

ZINC05051617

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 18th, 2006 22 Yes

Popular Name: 1-(4-chloro-3,5-dimethyl-phenoxy)-3-(2,6-dimethyl-1-piperidyl)-propan-2-ol 1-(4-chloro-3,5-dimethyl-phenoxy…

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Download: MOL2 SDF SMILES Flexibase

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) 4.38 -0.19 -36 2 3 1 33 326.888 5 ↓

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