| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 29th, 2010 | 20 | Yes |
Popular Name: 3-(3-aminoprop-1-ynyl)-N-[(2S)-2-cyanopropyl]-N-methyl-benzenesulfonamide 3-(3-aminoprop-1-ynyl)-N-[(2S)-2…
| 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) | 0.76 | 3.69 | -59.02 | 3 | 5 | 1 | 89 | 292.384 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.76 | 3.28 | -14.15 | 2 | 5 | 0 | 87 | 291.376 | 4 | ↓ |
