UCSF

ZINC43975500

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 21st, 2010 20 Yes

Popular Name: (1R)-N'-(2-methoxyethyl)-N'-[(1R)-2-methoxy-1-methyl-ethyl]-N-methyl-1-phenyl-ethane-1,2-diamine (1R)-N'-(2-methoxyethyl)-N'-[(1R…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

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) 2.01 4.63 -40.12 2 4 1 38 281.42 10 ↓
Hi High (pH 8-9.5) 2.01 3.74 -2.92 1 4 0 34 280.412 10 ↓
Mid Mid (pH 6-8) 2.01 6.66 -108.83 3 4 2 40 282.428 10 ↓

Activity (Go SEA)

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