In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 16 | Yes |
Popular Name: 5-chloro-6-(2-cyanoethyl-methyl-amino)pyridine-3-carboxylic 5-chloro-6-(2-cyanoethyl-methyl-…
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) | 0.78 | 4.55 | -47.03 | 0 | 5 | -1 | 80 | 238.654 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.78 | 5 | -47.81 | 1 | 5 | 0 | 81 | 239.662 | 4 | ↓ |