UCSF

ZINC33754446

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 17th, 2009 26 Yes

Popular Name: 1-Propanone, 1-(4-(4-ethoxybutoxy)-3-ethylphenyl)-3-(1-piperidinyl)-, hydrochloride; 4'-(4-Ethoxybutoxy)-3'-ethyl-3-piperidinopropiophenone hydrochloride; LS-125236; Propiophenone, 4'-(4-ethoxybutoxy)-3'-ethyl-3-piperidino-, hydrochloride; beta-Piperidino 1-Propanone, 1-(4-(4-ethoxybutox…

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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) 4.47 12.28 -42.12 1 4 1 40 362.534 12 ↓
Hi High (pH 8-9.5) 4.47 10.06 -7.6 0 4 0 39 361.526 12 ↓

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