In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 18 | Yes |
Popular Name: 6-[2-dimethylaminoethyl(isobutyl)amino]pyridine-3-carbonitrile 6-[2-dimethylaminoethyl(isobutyl…
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) | 2.05 | 9.15 | -40.73 | 1 | 4 | 1 | 44 | 247.366 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 6.69 | -6.09 | 0 | 4 | 0 | 43 | 246.358 | 6 | ↓ |