| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2011 | 31 | Yes |
Popular Name: 6-(3-aminophenyl)-N-[4-(4-methylpiperazin-1-yl)phenyl]quinolin-4-amine 6-(3-aminophenyl)-N-[4-(4-methyl…
| 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) | 4.98 | 11.25 | -79.39 | 5 | 5 | 2 | 60 | 411.553 | 4 | ↓ |
| Hi High (pH 8-9.5) | 4.98 | 8.45 | -8.68 | 3 | 5 | 0 | 57 | 409.537 | 4 | ↓ |
| Mid Mid (pH 6-8) | 4.98 | 8.89 | -31.98 | 4 | 5 | 1 | 59 | 410.545 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
