| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 21 | No |
Popular Name: 2-[4-[isopropyl(methyl)amino]butylamino]-4,6-dimethyl-pyridine-3-carbothioamide 2-[4-[isopropyl(methyl)amino]but…
| 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) | 2.71 | 8.24 | -88.04 | 5 | 4 | 2 | 57 | 310.511 | 8 | ↓ |
| Mid Mid (pH 6-8) | 2.71 | 7.93 | -42.12 | 4 | 4 | 1 | 55 | 309.503 | 8 | ↓ |
