In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 34 | Yes |
Popular Name: 2-(azepan-1-yl)ethyl-N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-methyl-oxo-BLAHcarboxamide 2-(azepan-1-yl)ethyl-N-[(1R,2R,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) | 4.25 | 12.27 | -43.19 | 2 | 7 | 1 | 72 | 469.65 | 5 | ↓ |