In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: (2R)-2-[3-aminopropyl(isobutyl)amino]-1-(azepan-1-yl)propan-1-one (2R)-2-[3-aminopropyl(isobutyl)a…
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) | 1.63 | 5.35 | -50.28 | 3 | 4 | 1 | 51 | 284.468 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 6.74 | -32.39 | 3 | 4 | 1 | 51 | 284.468 | 7 | ↓ |