In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2008 | 14 | Yes |
Popular Name: 6-(1-aminoethyl)-1,2,3,4-tetrahydroquinolin-2-one 6-(1-aminoethyl)-1,2,3,4-tetrahy…
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CAS Numbers: 1258650-15-5 , 151506-22-8
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) | -0.53 | 2.35 | -53.88 | 4 | 3 | 1 | 57 | 191.254 | 1 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 149 - 151 | Enamine Building Blocks |
MP | 149...151 | Enamine Building Blocks |
MP | 279 - 281 | Enamine Building Blocks |
MP | 279...281 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
PUBCHEM_PATENT_ID | WO2000058301A1 | IBM Patent Data |