| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 30th, 2009 | 17 | Yes |
Popular Name: 1H-Pyrrole-3-carboxylic acid, 2-(3,5-dimethylphenyl)-, methyl ester (9CI) 1H-Pyrrole-3-carboxylic acid, 2-…
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CAS Number: 816458-07-8
| 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) | 3.11 | 7.69 | -9.07 | 1 | 3 | 0 | 42 | 229.279 | 3 | ↓ |
