In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2006 | 12 | Yes |
Popular Name: 1-Methyl-3,4-dihydroquinolin-2(1H)-one 1-Methyl-3,4-dihydroquinolin-2(1…
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CAS Number: 826-72-2
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) | 1.20 | 5.38 | -7.32 | 0 | 2 | 0 | 20 | 161.204 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0462812A2; EP0462812B1; EP0623614A1; EP0623614B1 | IBM Patent Data |
PUBCHEM_PATENT_ID | WO2000058294A1 | IBM Patent Data |