| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 17 | No |
Popular Name: (2S)-2-carbamothioyl-N-[(3S)-1-ethyl-3-piperidyl]butanamide (2S)-2-carbamothioyl-N-[(3S)-1-e…
| 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) | 0.38 | 4.23 | -39.67 | 4 | 4 | 1 | 60 | 258.411 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.56 | 2.49 | -41.15 | 3 | 4 | 0 | 66 | 257.403 | 5 | ↓ |
