| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 29th, 2011 | 24 | Yes |
Popular Name: 2-[(2,2-diethyl-7-methyl-3H-1,4-benzoxazin-4-yl)methyl]benzonitrile 2-[(2,2-diethyl-7-methyl-3H-1,4-…
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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) | 5.25 | 11.46 | -6.48 | 0 | 3 | 0 | 36 | 320.436 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 5.25 | 11.98 | -31.76 | 1 | 3 | 1 | 37 | 321.444 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
