In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2009 | 20 | Yes |
Popular Name: N-[(1R)-1-(2-pyridyl)ethyl]-1,3-benzothiazole-6-carboxamide N-[(1R)-1-(2-pyridyl)ethyl]-1,3-…
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) | 2.33 | 5.4 | -11.33 | 1 | 4 | 0 | 55 | 283.356 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.33 | 5.82 | -47.82 | 2 | 4 | 1 | 56 | 284.364 | 3 | ↓ |