In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 1st, 2009 | 13 | Yes |
Popular Name: (2R)-6-fluoro-2-methyl-1,2,3,4-tetrahydroquinolin-5-amine (2R)-6-fluoro-2-methyl-1,2,3,4-t…
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) | 2.85 | 3.23 | -4.09 | 3 | 2 | 0 | 38 | 180.226 | 0 | ↓ |
Lo Low (pH 4.5-6) | 2.85 | 3.68 | -36.13 | 4 | 2 | 1 | 43 | 181.234 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4416884 | IBM Patent Data |