| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 18 | No |
Popular Name: MFCD09972078 MFCD09972078
Find On: PubMed — Wikipedia — Google
CAS Number: 1017791-54-6
3-(1,3-Benzothiazol-2-yl)benzoyl chloride
3-(1,3-benzothiazol-2-yl)benzoylchloride
| 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) | 4.72 | 8.03 | -10.94 | 0 | 2 | 0 | 30 | 273.744 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.