UCSF

ZINC22041988

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 23 Yes

Popular Name: 1-(4-tert-Butyl-1-phenylcyclohexyl)-4-methylpiperazine, hydrochloride; LS-110587; Piperazine, 1-(4-tert-butyl-1-phenylcyclohexyl)-4-methyl-, hydrochloride 1-(4-tert-Butyl-1-phenylcyclohex…

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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) 4.90 9.78 -32.47 1 2 1 8 315.525 3 ↓
Hi High (pH 8-9.5) 4.90 7.39 -1.64 0 2 0 6 314.517 3 ↓
Hi High (pH 8-9.5) 4.90 9.49 -32.05 1 2 1 8 315.525 3 ↓

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