| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 12th, 2008 | 15 | Yes |
Popular Name: methyl 2-{[(5-chloro-2-hydroxyphenyl)methyl]amino}acetate methyl 2-{[(5-chloro-2-hydroxyph…
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CAS Number: 1019577-98-0
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) | 1.95 | 3.2 | -44.47 | 3 | 4 | 1 | 63 | 230.671 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 2.51 | -43.08 | 1 | 4 | -1 | 61 | 228.655 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.95 | 1.72 | -9.86 | 2 | 4 | 0 | 59 | 229.663 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
