UCSF

ZINC31572154

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2009 20 Yes

Popular Name: 2-(N-(2-Diethylaminoethyl)-N-pentylamino)-4-methylpyridine; BRN 0403972; LS-131391; Pyridine, 2-(N-(2-diethylaminoethyl)-N-pentylamino)-4-methyl-; R.666 2-(N-(2-Diethylaminoethyl)-N-pen…

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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) 4.27 11.86 -32.35 1 3 1 21 278.464 10 ↓
Hi High (pH 8-9.5) 4.27 10.1 -26.34 1 3 1 21 278.464 10 ↓
Hi High (pH 8-9.5) 4.27 12.22 -90.49 2 3 2 22 279.472 10 ↓
Hi High (pH 8-9.5) 4.27 9.74 -4.04 0 3 0 19 277.456 10 ↓

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