| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 22nd, 2011 | 21 | Yes |
Popular Name: (NZ)-N-(3-methyl-1,3-benzothiazol-2-ylidene)-3-(4-pyridyl)propanamide (NZ)-N-(3-methyl-1,3-benzothiazo…
| 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) | 3.70 | 7.77 | -11.18 | 0 | 4 | 0 | 47 | 297.383 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.70 | 8.23 | -38.15 | 1 | 4 | 1 | 49 | 298.391 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.70 | 7.51 | -39.61 | 1 | 4 | 1 | 49 | 298.391 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
