UCSF

ZINC42457716

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 29th, 2010 13 Yes

Popular Name: N-ethyl-N'-isopentyl-N'-methyl-propane-1,3-diamine N-ethyl-N'-isopentyl-N'-methyl-p…

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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) 2.08 7.02 -98.94 3 2 2 21 188.359 8 ↓
Hi High (pH 8-9.5) 2.08 5.66 -33.42 2 2 1 16 187.351 8 ↓
Mid Mid (pH 6-8) 2.08 4.68 -35.31 2 2 1 20 187.351 8 ↓

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