UCSF

ZINC33829406

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 28th, 2009 30 Yes

Popular Name: BRN 1662268; Benzeneacetic acid, alpha-phenyl-, 1-((diethylamino)methyl)-2-(1-piperidinyl)ethyl ester; LS-28985; alpha-Phenylbenzeneacetic acid 1-((diethylamino)methyl)-2-(1-piperidinyl)ethyl ester BRN 1662268; Benzeneacetic acid,…

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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) 5.07 15.04 -34.85 1 4 1 34 409.594 11 ↓
Lo Low (pH 4.5-6) 5.07 16.63 -97.26 2 4 2 35 410.602 11 ↓
Lo Low (pH 4.5-6) 5.07 14.57 -33.59 1 4 1 34 409.594 11 ↓

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