| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 17th, 2010 | 27 | Yes |
Popular Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]quinazolin-4-amine 2-[4-(1,3-benzodioxol-5-ylmethyl…
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| 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) | 3.28 | 10.53 | -96.05 | 4 | 7 | 2 | 79 | 365.437 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | 8.33 | -28.25 | 3 | 7 | 1 | 78 | 364.429 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | 10.23 | -48.34 | 3 | 7 | 1 | 78 | 364.429 | 3 | ↓ |
| Mid Mid (pH 6-8) | 3.28 | 8.02 | -13 | 2 | 7 | 0 | 77 | 363.421 | 3 | ↓ |
