In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 2-[methyl(2-pyridylmethyl)amino]-5,6,7,8-tetrahydroquinoline-3-carbonitrile 2-[methyl(2-pyridylmethyl)amino]…
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) | 2.47 | 9.36 | -7.84 | 0 | 4 | 0 | 53 | 278.359 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 9.77 | -31.07 | 1 | 4 | 1 | 54 | 279.367 | 3 | ↓ |