| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 24 | Yes |
Popular Name: 2-(2-aminoethyl)-N-ethyl-N-[(1-ethylpyrazol-4-yl)methyl]quinazolin-4-amine 2-(2-aminoethyl)-N-ethyl-N-[(1-e…
| 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) | 1.38 | 7.77 | -49.19 | 3 | 6 | 1 | 74 | 325.44 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.38 | 7.39 | -10.47 | 2 | 6 | 0 | 73 | 324.432 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.38 | 8.35 | -98.15 | 4 | 6 | 2 | 76 | 326.448 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.38 | 8.32 | -104.69 | 4 | 6 | 2 | 76 | 326.448 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
