In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 2-[3-aminopropyl(isobutyl)amino]-1-(4-methylpiperazin-1-yl)ethanone 2-[3-aminopropyl(isobutyl)amino]…
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) | -0.22 | 4.1 | -92.82 | 4 | 5 | 2 | 56 | 272.437 | 7 | ↓ |
Hi High (pH 8-9.5) | -0.22 | 2.93 | -38.66 | 3 | 5 | 1 | 54 | 271.429 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.22 | 1.85 | -44.28 | 3 | 5 | 1 | 54 | 271.429 | 7 | ↓ |
Mid Mid (pH 6-8) | -0.22 | 5.67 | -176.44 | 5 | 5 | 3 | 57 | 273.445 | 7 | ↓ |