In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2004 | 17 | No |
Popular Name: 4-[(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)methyl]benzoic acid 4-[(2,5-dioxo-2,5-dihydro-1H-pyr…
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CAS Number: 64987-81-1
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) | 1.29 | 5.1 | -55.62 | 0 | 5 | -1 | 79 | 230.199 | 3 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
MP | 163 - 165 | Enamine Building Blocks |
MP | 163...165 | Enamine Building Blocks |
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |