In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 26th, 2005 | 30 | Yes |
Popular Name: 7-[6-chloro-4-(4-fluorophenyl)-2-methyl-3-quinolyl]-3,5-dihydroxy-hept-6-enoic 7-[6-chloro-4-(4-fluorophenyl)-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) | 4.20 | -1.97 | -52.86 | 2 | 5 | -1 | 93 | 428.867 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.20 | -1.92 | -72.9 | 3 | 5 | 0 | 94 | 429.875 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | US4761419 | IBM Patent Data |