In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 17 | Yes |
Popular Name: (6-chloro-3-pyridyl)-(4-methyl-1,4-diazepan-1-yl)methanone (6-chloro-3-pyridyl)-(4-methyl-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) | 0.85 | 5.98 | -46.42 | 1 | 4 | 1 | 38 | 254.741 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.85 | 3.97 | -6.75 | 0 | 4 | 0 | 36 | 253.733 | 1 | ↓ |