In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2010 | 21 | Yes |
Popular Name: 6-[(S)-(5-chloro-2-thienyl)-(methylamino)methyl]-7-fluoro-3,4-dihydro-1H-quinolin-2-one 6-[(S)-(5-chloro-2-thienyl)-(met…
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) | 3.73 | 6.89 | -50.54 | 3 | 3 | 1 | 46 | 325.816 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.73 | 5.92 | -7.6 | 2 | 3 | 0 | 41 | 324.808 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.