In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 19 | Yes |
Popular Name: 2-[4-[isopropyl(methyl)amino]butylamino]-1-(1-piperidyl)ethanone 2-[4-[isopropyl(methyl)amino]but…
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) | 1.25 | 7.95 | -97.44 | 3 | 4 | 2 | 41 | 271.449 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.25 | 6.61 | -37.38 | 2 | 4 | 1 | 37 | 270.441 | 8 | ↓ |