| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 5th, 2011 | 23 | Yes |
Popular Name: (2S)-2-methyl-3-[methyl-[2-(3-pyridyl)quinazolin-4-yl]amino]propanenitrile (2S)-2-methyl-3-[methyl-[2-(3-py…
None
| 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) | 3.34 | 9.84 | -12.13 | 0 | 5 | 0 | 66 | 303.369 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.34 | 10.19 | -32.49 | 1 | 5 | 1 | 67 | 304.377 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 3.34 | 10.19 | -35.33 | 1 | 5 | 1 | 67 | 304.377 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
