| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 4th, 2010 | 17 | No |
Popular Name: 2-[methyl-[(1S)-1,2,2-trimethylpropyl]amino]pyridine-4-carbothioamide 2-[methyl-[(1S)-1,2,2-trimethylp…
| 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) | 2.92 | 6.31 | -11.8 | 2 | 3 | 0 | 42 | 251.399 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.92 | 6.69 | -40.67 | 3 | 3 | 1 | 43 | 252.407 | 4 | ↓ |
