| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 8th, 2011 | 25 | Yes |
Popular Name: 2,4-diamino-8-chloro-5-fluoro-7-(4-methoxyanilino)quinazoline-6-carbonitrile 2,4-diamino-8-chloro-5-fluoro-7-…
| 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) | 3.35 | 6.02 | -9.04 | 5 | 7 | 0 | 123 | 358.764 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 3.35 | 6.46 | -34.4 | 6 | 7 | 1 | 124 | 359.772 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
