In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 18th, 2010 | 13 | Yes |
Popular Name: 2-(1,3-benzothiazol-2-yl)propan-1-amine 2-(1,3-benzothiazol-2-yl)propan-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1223501-17-4 , 1384430-37-8
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) | 1.41 | 3.45 | -48.15 | 3 | 2 | 1 | 41 | 193.295 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 160 - 162 | Enamine Building Blocks |
MP | 160...162 | Enamine Building Blocks |
MP | 64 - 66 | Enamine Building Blocks |
MP | 64...66 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
PUBCHEM_PATENT_ID | EP0277701A1; US4874760 | IBM Patent Data |