In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 5-amino-2-[2-cyanoethyl(isobutyl)amino]pyridine-3-carboxamide 5-amino-2-[2-cyanoethyl(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) | 0.12 | 3.29 | -9.62 | 4 | 6 | 0 | 109 | 261.329 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.12 | 3.29 | -38.74 | 5 | 6 | 1 | 110 | 262.337 | 6 | ↓ |