| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 12th, 2006 | 17 | No |
Popular Name: 2-acetonylsulfanyl-5,6,7,8-tetrahydroquinoline-3-carbonitrile 2-acetonylsulfanyl-5,6,7,8-tetra…
| 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) | 2.28 | 1.41 | -10.81 | 0 | 3 | 0 | 54 | 246.335 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 2.28 | 1.52 | -41.19 | 1 | 3 | 1 | 55 | 247.343 | 3 | ↓ |
