| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 16th, 2008 | 12 | Yes |
Popular Name: 3-Methyl-2-(1H-pyrrol-1-yl)butanoic acid 3-Methyl-2-(1H-pyrrol-1-yl)butan…
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CAS Numbers: , 61429-10-5 , 61429-10-5; 63751-71-3; 63813-68-3; 66036-32-6 , [61429-10-5]
1H-pyrrole-1-acetic acid, a-(1-methylethyl)-
3-methyl-2-(1h-pyrrol-1-yl)butanoicacid
| 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) | 1.28 | 6.11 | -44.5 | 0 | 3 | -1 | 45 | 166.2 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
