| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 16 | Yes |
Popular Name: methyl 2-{[(4-chlorophenyl)methyl]amino}-2-methylpropanoate methyl 2-{[(4-chlorophenyl)methy…
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CAS Number: 1157807-51-6
Methyl 2-{[(4-chlorophenyl)methyl]-amino}-2-methylpropanoate
| 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) | 2.85 | 6.83 | -44.66 | 2 | 3 | 1 | 43 | 242.726 | 5 | ↓ |
| Mid Mid (pH 6-8) | 2.85 | 5.63 | -5.76 | 1 | 3 | 0 | 38 | 241.718 | 5 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Purity | >95% | Matrix Scientific |
| Warnings | IRRITANT | Matrix Scientific |
