In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2008 | 21 | Yes |
Popular Name: N-[6-(4-methylpiperazin-1-yl)-3-pyridyl]cyclopentanecarboxamide N-[6-(4-methylpiperazin-1-yl)-3-…
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) | 2.16 | 6.65 | -43.18 | 2 | 5 | 1 | 50 | 289.403 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.16 | 4.18 | -10.56 | 1 | 5 | 0 | 48 | 288.395 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.16 | 4.47 | -37.41 | 2 | 5 | 1 | 50 | 289.403 | 3 | ↓ |