In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2011 | 19 | Yes |
Popular Name: 5,7-dichloro-2-methyl-8-[(3R)-pyrrolidin-3-yl]oxy-quinoline 5,7-dichloro-2-methyl-8-[(3R)-py…
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) | 3.45 | 6.23 | -39.17 | 2 | 3 | 1 | 39 | 298.193 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.45 | 5.35 | -5.37 | 1 | 3 | 0 | 34 | 297.185 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.