In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2009 | 23 | Yes |
Popular Name: (3,6-dichloro-2-pyridyl)-[4-(2-pyridylmethyl)piperazin-1-yl]methanone (3,6-dichloro-2-pyridyl)-[4-(2-p…
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) | 2.36 | 5.78 | -9.38 | 0 | 5 | 0 | 49 | 351.237 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.36 | 6.51 | -35.26 | 1 | 5 | 1 | 51 | 352.245 | 3 | ↓ |