General Information of the Compound
| Compound ID |
CP0705371
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| Compound Name |
12,13-[2-carbomethoxy-1,4-but-cis-2-enyl]-6,7,12,13-tetrahyhydro-5,7-dioxo-5H-indolo[2,3-a]pyrrolo[3,4-c]carbazole
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| Structure |
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| Formula |
C26H17N3O3
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| Molecular Weight |
419.44
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| Canonical SMILES |
CC(=O)/C1=C/Cn2c3ccccc3c3c4c(c5c6ccccc6n(c5c32)C1)C(=O)NC4=O
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| InChI |
InChI=1S/C26H17N3O3/c1-13(30)14-10-11-28-17-8-4-2-6-15(17)19-21-22(26(32)27-25(21)31)20-16-7-3-5-9-18(16)29(12-14)24(20)23(19)28/h2-10H,11-12H2,1H3,(H,27,31,32)/b14-10+
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| InChIKey |
NYZNNKMKRXQWHA-GXDHUFHOSA-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