In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 31st, 2009 | 25 | Yes |
Popular Name: 3-(4-bromophenyl)-1-[(3S)-3-(dimethylaminomethyl)-3,4-dihydro-2H-quinolin-1-yl]propan-1-one 3-(4-bromophenyl)-1-[(3S)-3-(dim…
None
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) | 4.21 | 13.14 | -52.23 | 1 | 3 | 1 | 25 | 402.356 | 5 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | WO1999052875A1 | IBM Patent Data |