| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 21 | No |
Popular Name: (2R)-3-amino-2-benzyl-N-[(3R)-1-methyl-3-piperidyl]-3-thioxo-propanamide (2R)-3-amino-2-benzyl-N-[(3R)-1-…
| 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) | 0.93 | 6.53 | -42.59 | 4 | 4 | 1 | 60 | 306.455 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.11 | 5.28 | -43.02 | 3 | 4 | 0 | 66 | 305.447 | 5 | ↓ |
