| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 6th, 2005 | 11 | Yes |
Popular Name: 2,3,4,5-Tetrahydro-1,5-benzothiazepine 2,3,4,5-Tetrahydro-1,5-benzothia…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 40358-33-6 , [40358-33-6]
1,5-benzothiazepine, 2,3,4,5-tetrahydro-, hydrobromide
| 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) | 2.31 | -1.58 | -3.48 | 1 | 1 | 0 | 12 | 165.261 | 0 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 22 - 24 | Enamine Building Blocks |
| MP | 22...24 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| PUBCHEM_PATENT_ID | EP0450097A1; EP0450097B1; US5559230; US5753677; US5985869; WO1994001113A1 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
