In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 20 | Yes |
Popular Name: (5,6-dichloro-3-pyridyl)-(4-isobutylpiperazin-1-yl)methanone (5,6-dichloro-3-pyridyl)-(4-isob…
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) | 2.31 | 7.48 | -45.44 | 1 | 4 | 1 | 38 | 317.24 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 5.59 | -5.78 | 0 | 4 | 0 | 36 | 316.232 | 3 | ↓ |