In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 21st, 2011 | 30 | Yes |
Popular Name: 2-(4-bromophenyl)-N-[[6,7-dimethoxy-2-(3-thienyl)-3-quinolyl]methyl]ethanamine 2-(4-bromophenyl)-N-[[6,7-dimeth…
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) | 5.14 | 10.59 | -10.93 | 1 | 4 | 0 | 43 | 483.431 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.14 | 11.82 | -65.57 | 2 | 4 | 1 | 48 | 484.439 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.