| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 25 | Yes |
Popular Name: 2-(2-aminoethyl)-N-[(3,5-dimethyl-1-propyl-pyrazol-4-yl)methyl]quinazolin-4-amine 2-(2-aminoethyl)-N-[(3,5-dimethy…
| 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) | 1.70 | 6.81 | -48.36 | 4 | 6 | 1 | 83 | 339.467 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.70 | 6.43 | -10.61 | 3 | 6 | 0 | 82 | 338.459 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.70 | 7.36 | -102.54 | 5 | 6 | 2 | 85 | 340.475 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
