UCSF

ZINC19901138

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 14 Yes

Popular Name: N-butyl-N',N'-diisopropyl-ethane-1,2-diamine N-butyl-N',N'-diisopropyl-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) 2.56 4.83 -38.59 2 2 1 20 201.378 8 ↓
Mid Mid (pH 6-8) 2.56 6.89 -108.66 3 2 2 21 202.386 8 ↓
Mid Mid (pH 6-8) 2.56 5.73 -27.86 2 2 1 16 201.378 8 ↓

Activity (Go SEA)

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