| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 20 | Yes |
Popular Name: 3-[(1S)-1-aminopropyl]-N-(2-cyanoethyl)-N-ethyl-benzenesulfonamide 3-[(1S)-1-aminopropyl]-N-(2-cyan…
| 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) | -0.57 | 4.28 | -62.37 | 3 | 5 | 1 | 89 | 296.416 | 7 | ↓ |
| Hi High (pH 8-9.5) | -0.57 | 3.97 | -13.27 | 2 | 5 | 0 | 87 | 295.408 | 7 | ↓ |
