| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 1st, 2009 | 25 | No |
Popular Name: [{2-[(1,3-Benzodioxol-5-ylmethyl)amino]-2-oxoethyl}(phenyl)amino]acetic acid [{2-[(1,3-Benzodioxol-5-ylmethyl…
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CAS Numbers: 1142204-62-3 , [1142204-62-3]
BENZODIOXOLYLMETHYLAMINOOXOETHYLPHENYLAMINOACETICACI
[{2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}(phenyl)amino]aceticacid
| 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) | 1.27 | 7.36 | -52.06 | 1 | 7 | -1 | 91 | 341.343 | 7 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
