| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 7th, 2004 | 20 | Yes |
Popular Name: 3-[1-(3,4-Dimethyl-phenyl)-2,5-dimethyl-1H-pyrrol-3-yl]-3-oxo-propionitrile 3-[1-(3,4-Dimethyl-phenyl)-2,5-d…
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CAS Number: 736146-05-7
| 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) | 2.58 | 4.75 | -13.33 | 0 | 3 | 0 | 45 | 266.344 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
