UCSF

ZINC22042366

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 12th, 2008 23 Yes

Popular Name: 1,2-Ethanediamine, N,N-diethyl-N'-(2-methylpropyl)-N'-(1-naphthalenylmethyl)-; BRN 2743141; Ethylenediamine, N,N-diethyl-N'-isobutyl-N'-(1-naphthylmethyl)-; LS-65412; N,N-Diethyl-N'-(2-methylpropyl)-N'-(1-naphthalenylmethyl)-1,2-ethanediamine; N-(2-Dietil 1,2-Ethanediamine, N,N-diethyl-N…

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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) 4.80 11.87 -35.48 1 2 1 8 313.509 9 ↓
Mid Mid (pH 6-8) 4.80 12.04 -37.08 1 2 1 8 313.509 9 ↓
Lo Low (pH 4.5-6) 4.80 13.98 -119.56 2 2 2 9 314.517 9 ↓

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