| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 30th, 2011 | 24 | Yes |
Popular Name: 2-[[(3R)-3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]methyl]quinazolin-4-amine 2-[[(3R)-3-ethyl-4-(2-methoxyeth…
| 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) | 1.79 | 5.45 | -34.74 | 3 | 6 | 1 | 69 | 330.456 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 3.29 | -10.61 | 2 | 6 | 0 | 68 | 329.448 | 6 | ↓ |
| Mid Mid (pH 6-8) | 1.79 | 3.6 | -26.56 | 3 | 6 | 1 | 69 | 330.456 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.79 | 5.76 | -77.14 | 4 | 6 | 2 | 70 | 331.464 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
