In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 18 | Yes |
Popular Name: 2-[[(1S,2R,3R)-2,3-dimethylcyclohexyl]amino]pyridine-3-carboxamide 2-[[(1S,2R,3R)-2,3-dimethylcyclo…
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 | 4.19 | -10.05 | 3 | 4 | 0 | 68 | 247.342 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.05 | 4.48 | -34.91 | 4 | 4 | 1 | 69 | 248.35 | 3 | ↓ |