| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 29th, 2011 | 25 | Yes |
Popular Name: 2-[[(3R)-4-(2-ethoxyethyl)-3-ethyl-piperazin-1-yl]methyl]quinazolin-4-amine 2-[[(3R)-4-(2-ethoxyethyl)-3-eth…
| 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) | 2.17 | 6.43 | -34.82 | 3 | 6 | 1 | 69 | 344.483 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 4.58 | -26.42 | 3 | 6 | 1 | 69 | 344.483 | 7 | ↓ |
| Mid Mid (pH 6-8) | 2.17 | 4.27 | -10.51 | 2 | 6 | 0 | 68 | 343.475 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 2.17 | 6.73 | -77.4 | 4 | 6 | 2 | 70 | 345.491 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
