UCSF

ZINC33823931

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 28 Yes

Popular Name: 4-Piperidinol, 2,5-dimethyl-1-(3-(4-morpholinyl)propyl)-4-phenyl-, propanoate ditartrate; 4-Piperidinol, 2,5-dimethyl-4-phenyl-1-(3-morpholinopropyl)-, propionate (ester), ditartrate, dihydrate; LS-117024; Piperidine, 2,5-dimethyl-1-morpholinopropyl-4-phe 4-Piperidinol, 2,5-dimethyl-1-(3…

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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) 3.78 9.97 -42.95 1 5 1 43 389.56 8 ↓
Mid Mid (pH 6-8) 3.78 8.23 -6.37 0 5 0 42 388.552 8 ↓
Mid Mid (pH 6-8) 3.78 10.5 -42.25 1 5 1 43 389.56 8 ↓
Lo Low (pH 4.5-6) 3.78 12.24 -115.87 2 5 2 44 390.568 8 ↓

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