In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 18 | No |
Popular Name: N'-hydroxy-2-(4-methyl-1,4-diazepan-1-yl)pyridine-3-carboxamidine N'-hydroxy-2-(4-methyl-1,4-diaze…
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) | -0.43 | 4.03 | -36.32 | 4 | 6 | 1 | 79 | 250.326 | 2 | ↓ |
Hi High (pH 8-9.5) | -0.43 | 2.01 | -10.07 | 3 | 6 | 0 | 78 | 249.318 | 2 | ↓ |
Lo Low (pH 4.5-6) | -0.43 | 4.43 | -96.71 | 5 | 6 | 2 | 80 | 251.334 | 2 | ↓ |