In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 19 | Yes |
Popular Name: 1-(4-amino-1-piperidyl)-4-(4-methylpiperazin-1-yl)butan-1-one 1-(4-amino-1-piperidyl)-4-(4-met…
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) | -0.61 | 3.29 | -94.33 | 4 | 5 | 2 | 56 | 270.421 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.61 | 0.82 | -55.33 | 3 | 5 | 1 | 54 | 269.413 | 4 | ↓ |
Mid Mid (pH 6-8) | -0.61 | 3.15 | -97.43 | 4 | 5 | 2 | 56 | 270.421 | 4 | ↓ |