In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 28 | Yes |
Popular Name: N-[6-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-3-pyridyl]thiophene-2-carboxamide N-[6-[4-[(4-chlorophenyl)methyl]…
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) | 4.07 | 9.08 | -10.09 | 1 | 5 | 0 | 48 | 412.946 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.07 | 11.3 | -49.44 | 2 | 5 | 1 | 50 | 413.954 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.07 | 11.62 | -109.65 | 3 | 5 | 2 | 51 | 414.962 | 5 | ↓ |