In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 35 | Yes |
Popular Name: 3-methoxy-N-[6-[4-[[3-(trifluoromethyl)phenyl]methyl]-1,4-diazepan-1-yl]-3-pyridyl]benzamide 3-methoxy-N-[6-[4-[[3-(trifluoro…
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) | 4.67 | 13.23 | -49.84 | 2 | 6 | 1 | 59 | 485.53 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.67 | 13.55 | -108.5 | 3 | 6 | 2 | 60 | 486.538 | 7 | ↓ |