In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 32 | Yes |
Popular Name: N-[6-[4-(2-phenoxyacetyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide N-[6-[4-(2-phenoxyacetyl)-1,4-di…
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) | 3.37 | 12.14 | -19.11 | 1 | 7 | 0 | 75 | 430.508 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.37 | 12.44 | -49.97 | 2 | 7 | 1 | 76 | 431.516 | 6 | ↓ |