In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 18 | Yes |
Popular Name: 2-[methyl(4-pyridylmethyl)amino]pyridine-3-carboxylic 2-[methyl(4-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) | 0.77 | 7.94 | -43.05 | 1 | 5 | 0 | 70 | 243.266 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.77 | 7.49 | -47.47 | 0 | 5 | -1 | 69 | 242.258 | 4 | ↓ |
Lo Low (pH 4.5-6) | 0.77 | 8.4 | -84.7 | 2 | 5 | 1 | 72 | 244.274 | 4 | ↓ |