In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | No |
Popular Name: 6-methyl-2-[propyl(2,2,2-trifluoroethyl)amino]pyridine-3-carbothioamide 6-methyl-2-[propyl(2,2,2-trifluo…
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) | 2.75 | 6.5 | -10.55 | 2 | 3 | 0 | 42 | 291.342 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 6.91 | -34.81 | 3 | 3 | 1 | 43 | 292.35 | 6 | ↓ |