In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 19 | Yes |
Popular Name: N-[6-(1,4-diazepan-1-yl)-3-pyridyl]-2-methyl-propanamide N-[6-(1,4-diazepan-1-yl)-3-pyrid…
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) | 1.18 | 5.56 | -45.75 | 3 | 5 | 1 | 62 | 263.365 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.18 | 5.88 | -95.46 | 4 | 5 | 2 | 63 | 264.373 | 3 | ↓ |