| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 25 | Yes |
Popular Name: 2-(2-aminoethyl)-N-[(1R)-2-methoxy-1-(2-pyridyl)ethyl]-N-methyl-quinazolin-4-amine 2-(2-aminoethyl)-N-[(1R)-2-metho…
| 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) | 1.25 | 7.08 | -45.84 | 3 | 6 | 1 | 79 | 338.435 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.25 | 6.7 | -8.38 | 2 | 6 | 0 | 77 | 337.427 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 7.63 | -99.54 | 4 | 6 | 2 | 80 | 339.443 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 7.58 | -163.31 | 5 | 6 | 3 | 81 | 340.451 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.25 | 7.02 | -89.42 | 4 | 6 | 2 | 80 | 339.443 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
