In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 17 | No |
Popular Name: 6-[ethyl(2,2,2-trifluoroethyl)amino]pyridine-3-carbothioamide 6-[ethyl(2,2,2-trifluoroethyl)am…
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) | 2.25 | 5.86 | -13.25 | 2 | 3 | 0 | 42 | 263.288 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.25 | 6.15 | -45.17 | 3 | 3 | 1 | 43 | 264.296 | 5 | ↓ |