| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 20 | Yes |
Popular Name: (2S)-N-[(1S)-1-(2,4-dimethylthiazol-5-yl)ethyl]-2-piperazin-1-yl-propanamide (2S)-N-[(1S)-1-(2,4-dimethylthia…
| 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) | 0.14 | 2.07 | -43.25 | 3 | 5 | 1 | 62 | 297.448 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.14 | 0.72 | -8.8 | 2 | 5 | 0 | 57 | 296.44 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
