In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 18 | Yes |
Popular Name: 2-amino-N-[5-(4-methylpiperazin-1-yl)-2-pyridyl]acetamide 2-amino-N-[5-(4-methylpiperazin-…
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) | -0.45 | 1.67 | -95.46 | 5 | 6 | 2 | 77 | 251.334 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.45 | -1.2 | -16.1 | 3 | 6 | 0 | 74 | 249.318 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.45 | 1.28 | -49.02 | 4 | 6 | 1 | 76 | 250.326 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.45 | -0.81 | -53.53 | 4 | 6 | 1 | 76 | 250.326 | 3 | ↓ |