| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 24th, 2009 | 13 | Yes |
Popular Name: Benzonitrile, 3-methyl-4-(1-methylethoxy)- (9CI) Benzonitrile, 3-methyl-4-(1-meth…
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CAS Number: 610797-50-7
| 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) | 2.87 | 6.49 | -5.04 | 0 | 2 | 0 | 33 | 175.231 | 2 | ↓ |
