In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 17 | Yes |
Popular Name: [4-(4-aminobutyl)piperazin-1-yl]-[(1S,2R)-2-methylcyclopropyl]methanone [4-(4-aminobutyl)piperazin-1-yl]…
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) | 0.38 | 3.11 | -47.58 | 3 | 4 | 1 | 51 | 240.371 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.38 | 5.32 | -106.79 | 4 | 4 | 2 | 52 | 241.379 | 5 | ↓ |