In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 25 | No |
Popular Name: azepan-1-yl-[(3R)-1-[(2-nitrophenyl)methyl]-3-piperidyl]methanone azepan-1-yl-[(3R)-1-[(2-nitrophe…
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) | 3.19 | 10.04 | -12 | 0 | 6 | 0 | 69 | 345.443 | 4 | ↓ |