In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 29 | Yes |
Popular Name: 3-(2-chlorophenyl)-5-methyl-N-[[1-(2-pyridyl)-4-piperidyl]methyl]isoxazole-4-carboxamide 3-(2-chlorophenyl)-5-methyl-N-[[…
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) | 3.67 | 10.72 | -41.43 | 2 | 6 | 1 | 73 | 411.913 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 10.41 | -14.69 | 1 | 6 | 0 | 71 | 410.905 | 5 | ↓ |