General Information of the Compound
| Compound ID |
CP0412551
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| Compound Name |
10-Benzyloxy-1H-pyrido[3'4':4,5]pyrrolo[2,3-a]-pyrrolo[3,4-c]carbazole-5,7-(6H,12H)-dione
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| Structure |
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| Formula |
C26H16N4O3
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| Molecular Weight |
432.439
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| Canonical SMILES |
O=C1NC(=O)c2c1c1c3ccc(OCc4ccccc4)cc3[nH]c1c1[nH]c3ccncc3c21
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| InChI |
InChI=1S/C26H16N4O3/c31-25-21-19-15-7-6-14(33-12-13-4-2-1-3-5-13)10-18(15)29-23(19)24-20(22(21)26(32)30-25)16-11-27-9-8-17(16)28-24/h1-11,28-29H,12H2,(H,30,31,32)
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| InChIKey |
MHKJVRFSWIHODA-UHFFFAOYSA-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