In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2010 | 22 | Yes |
Popular Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridyl]-4-(3-methoxypropyl)piperazine 1-[3-chloro-5-(trifluoromethyl)-…
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) | 2.79 | 8.14 | -38.53 | 1 | 4 | 1 | 30 | 338.781 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.79 | 5.94 | -3.88 | 0 | 4 | 0 | 29 | 337.773 | 6 | ↓ |