In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 8th, 2006 | 25 | Yes |
Popular Name: 2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanyl]-N-(2-isopropyl-6-methyl-phenyl)-acetamide 2-[(3-cyano-4,6-dimethyl-2-pyrid…
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) | 3.42 | 10.39 | -13.58 | 1 | 4 | 0 | 66 | 353.491 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.42 | 10.61 | -48.06 | 2 | 4 | 1 | 67 | 354.499 | 5 | ↓ |