UCSF

ZINC13468221

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 20th, 2008 15 Yes

Popular Name: Cyclohexyl-(1-phenyl-ethyl)-aminehydrochloride Cyclohexyl-(1-phenyl-ethyl)-amin…

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CAS Numbers: 91524-52-6 , [91524-52-6]

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) 3.96 8.43 -35.49 2 1 1 17 204.337 3 ↓

Vendor Notes

Note Type Comments Provided By
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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