In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 37 | Yes |
Popular Name: 4-methyl-N-[6-[4-[(3-phenoxyphenyl)methyl]-1,4-diazepan-1-yl]-3-pyridyl]benzamide 4-methyl-N-[6-[4-[(3-phenoxyphen…
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) | 5.94 | 16.43 | -46.72 | 2 | 6 | 1 | 59 | 493.631 | 7 | ↓ |
Lo Low (pH 4.5-6) | 5.94 | 16.72 | -104.28 | 3 | 6 | 2 | 60 | 494.639 | 7 | ↓ |