| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 1st, 2008 | 16 | Yes |
Popular Name: 3-[(2-hydroxy-4-methylphenyl)formamido]propanoic acid 3-[(2-hydroxy-4-methylphenyl)for…
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CAS Number: 1016720-46-9
| 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) | 1.56 | 2.52 | -59.25 | 2 | 5 | -1 | 89 | 222.22 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.56 | 3.55 | -116.14 | 1 | 5 | -2 | 92 | 221.212 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| MP | 159 - 161 | Enamine Building Blocks |
| MP | 159...161 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
