In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 18 | No |
Popular Name: 1-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-1H-pyrrole-2-carbaldehyde 1-(1,3-dioxo-1,3-dihydro-2H-isoi…
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CAS Number: 423152-35-6
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) | 2.14 | 2.62 | -19.37 | 0 | 5 | 0 | 61 | 240.218 | 2 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
melting_point | 197 - 199 | KeyOrganics |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
No pre-computed analogs available. Try a structural similarity search.