UCSF

ZINC22040960

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 28 Yes

Popular Name: 1-Butyl-1,3-diphenyl-2-(4-methyl-1-piperazinylmethyl)-1-propanol dihydrochloride; 1-Piperazinepropanol, beta-benzyl-alpha-butyl-4-methyl-alpha-phenyl-, dihydrochloride; 1-Propanol, 1-butyl-1,3-diphenyl-2-(4-methyl-1-piperazinylmethyl)-, dihydrochloride; L 1-Butyl-1,3-diphenyl-2-(4-methyl…

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Annotations

Vendors

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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) 5.37 13.36 -38 2 3 1 28 381.584 9 ↓
Hi High (pH 8-9.5) 5.37 10.95 -3.37 1 3 0 27 380.576 9 ↓

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