| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 24th, 2009 | 21 | Yes |
Popular Name: 6-Benzothiazolol, 4,5,7-trimethyl-2-[(phenylmethyl)amino]- 6-Benzothiazolol, 4,5,7-trimethy…
Find On: PubMed — Wikipedia — Google
CAS Number: 120165-71-1
| 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) | 4.64 | 7.19 | -7.81 | 2 | 3 | 0 | 45 | 298.411 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 4.64 | 7.58 | -26.83 | 3 | 3 | 1 | 46 | 299.419 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| PUBCHEM_PATENT_ID | EP0295656A1 | IBM Patent Data |
