| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 11th, 2009 | 15 | No |
Popular Name: 3-amino-N-[(1R)-1-(4-pyridyl)ethyl]-3-thioxo-propanamide 3-amino-N-[(1R)-1-(4-pyridyl)eth…
| 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) | -0.73 | 1.87 | -18.08 | 3 | 4 | 0 | 68 | 223.301 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.73 | 2.33 | -50.97 | 4 | 4 | 1 | 69 | 224.309 | 4 | ↓ |
