| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 17th, 2011 | 22 | Yes |
Popular Name: N2,N2-dimethyl-N4-[(1S)-1-(3-pyridyl)ethyl]-5,6,7,8-tetrahydroquinazoline-2,4-diamine N2,N2-dimethyl-N4-[(1S)-1-(3-pyr…
| 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) | 3.07 | 10.74 | -26.11 | 2 | 5 | 1 | 55 | 298.414 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.07 | 10.42 | -7.99 | 1 | 5 | 0 | 54 | 297.406 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.07 | 11.16 | -73.41 | 3 | 5 | 2 | 56 | 299.422 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
