In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2010 | 20 | Yes |
Popular Name: N-[2-(dimethylamino)-3-pyridyl]-2-methylsulfanyl-pyridine-3-carboxamide N-[2-(dimethylamino)-3-pyridyl]-…
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) | 1.63 | 5.82 | -12 | 1 | 5 | 0 | 58 | 288.376 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.63 | 6.37 | -35.23 | 2 | 5 | 1 | 59 | 289.384 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.