| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 31st, 2005 | 17 | Yes |
Popular Name: 9-prop-2-ynylsulfanyl-8-azabicyclo[5.4.0]undeca-8,10,12-triene-10-carbonitrile 9-prop-2-ynylsulfanyl-8-azabicyc…
| 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) | 3.40 | 2.42 | -7.36 | 0 | 2 | 0 | 36 | 242.347 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 3.40 | 2.57 | -35.31 | 1 | 2 | 1 | 37 | 243.355 | 2 | ↓ |
