In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 32 | Yes |
Popular Name: 2-chloro-N-[6-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]-3-pyridyl]benzamide 2-chloro-N-[6-[4-(2-phenylacetyl…
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) | 4.12 | 12.72 | -17.13 | 1 | 6 | 0 | 66 | 448.954 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.12 | 13.09 | -47.4 | 2 | 6 | 1 | 67 | 449.962 | 5 | ↓ |