In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 32 | Yes |
Popular Name: 2-(4-chlorophenoxy)-N-[6-[4-[(3-fluorophenyl)methyl]piperazin-1-yl]-3-pyridyl]acetamide 2-(4-chlorophenoxy)-N-[6-[4-[(3-…
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) | 4.28 | 10.64 | -15.11 | 1 | 6 | 0 | 58 | 454.933 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 12.86 | -52.64 | 2 | 6 | 1 | 59 | 455.941 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.28 | 10.96 | -41.63 | 2 | 6 | 1 | 59 | 455.941 | 7 | ↓ |