| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 23rd, 2010 | 17 | No |
Popular Name: (2S)-3-amino-N,2-dimethyl-N-[2-(2-pyridyl)ethyl]-3-thioxo-propanamide (2S)-3-amino-N,2-dimethyl-N-[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) | -0.04 | 4.24 | -15.72 | 2 | 4 | 0 | 59 | 251.355 | 5 | ↓ |
| Lo Low (pH 4.5-6) | -0.04 | 4.6 | -43.08 | 3 | 4 | 1 | 60 | 252.363 | 5 | ↓ |
