General Information of the Compound
| Compound ID |
CP0468054
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| Compound Name |
3-[(4E)-4-hydroxyimino-2-pyrrolo[1,2-c]pyrimidin-3-ylchromen-6-yl]oxy-N,N-dimethylazetidine-1-carboxamide
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| Structure |
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| Formula |
C22H21N5O4
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| Molecular Weight |
419.441
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| Canonical SMILES |
CN(C)C(=O)N1CC(C1)Oc1ccc2oc(c\c(=N/O)c2c1)-c1cc2cccn2cn1
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| InChI |
InChI=1S/C22H21N5O4/c1-25(2)22(28)27-11-16(12-27)30-15-5-6-20-17(9-15)18(24-29)10-21(31-20)19-8-14-4-3-7-26(14)13-23-19/h3-10,13,16,29H,11-12H2,1-2H3/b24-18+
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| InChIKey |
DGCDCXGDNVBQOY-HKOYGPOVSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound