| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 5th, 2010 | 18 | Yes |
Popular Name: (2S)-N-[(2-methylthiazol-5-yl)methyl]-2-piperazin-1-yl-propanamide (2S)-N-[(2-methylthiazol-5-yl)me…
| 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) | -0.64 | 0.69 | -42.99 | 3 | 5 | 1 | 62 | 269.394 | 4 | ↓ |
| Hi High (pH 8-9.5) | -0.64 | -0.67 | -8.56 | 2 | 5 | 0 | 57 | 268.386 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
