| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 20 | No |
Popular Name: 2-(1,4-thiazepan-4-yl)-5,6,7,8-tetrahydroquinoline-3-carbothioamide 2-(1,4-thiazepan-4-yl)-5,6,7,8-t…
| 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) | 2.94 | 8.61 | -10.48 | 2 | 3 | 0 | 42 | 307.488 | 2 | ↓ |
| Mid Mid (pH 6-8) | 2.94 | 9 | -34.22 | 3 | 3 | 1 | 43 | 308.496 | 2 | ↓ |
