In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 17 | No |
Popular Name: 6-[2-[(2S)-tetrahydrofuran-2-yl]ethylamino]pyridine-3-carbothioamide 6-[2-[(2S)-tetrahydrofuran-2-yl]…
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) | 0.98 | 3.51 | -13.01 | 3 | 4 | 0 | 60 | 251.355 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.98 | 3.98 | -45.69 | 4 | 4 | 1 | 61 | 252.363 | 5 | ↓ |