In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2009 | 29 | Yes |
Popular Name: N-[6-(4-isopentyl-1,4-diazepan-1-yl)-3-pyridyl]-3-methoxy-benzamide N-[6-(4-isopentyl-1,4-diazepan-1…
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) | 4.05 | 11.32 | -43.74 | 2 | 6 | 1 | 59 | 397.543 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.05 | 11.67 | -100.9 | 3 | 6 | 2 | 60 | 398.551 | 7 | ↓ |