UCSF

ZINC44381192

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 24th, 2010 14 Yes

Popular Name: N-ethyl-N',N'-diisobutyl-ethane-1,2-diamine N-ethyl-N',N'-diisobutyl-ethane-…

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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) 2.40 7.76 -108.75 3 2 2 21 202.386 8 ↓
Mid Mid (pH 6-8) 2.40 6.19 -36.1 2 2 1 20 201.378 8 ↓
Mid Mid (pH 6-8) 2.40 6.4 -30.41 2 2 1 16 201.378 8 ↓

Activity (Go SEA)

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