General Information of the Compound
| Compound ID |
CP0449053
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| Compound Name |
4-hydroxy-7-hydroxysulfonyloxybenzo[a]pyrrolo[3,4-c]carbazole-1,3(2H,8H)-dione
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| Structure |
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| Formula |
C18H10N2O7S
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| Molecular Weight |
398.352
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| Canonical SMILES |
Oc1ccc(OS(O)(=O)=O)c2c3[nH]c4ccccc4c3c3C(=O)NC(=O)c3c12
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| InChI |
InChI=1S/C18H10N2O7S/c21-9-5-6-10(27-28(24,25)26)13-12(9)15-14(17(22)20-18(15)23)11-7-3-1-2-4-8(7)19-16(11)13/h1-6,19,21H,(H,20,22,23)(H,24,25,26)
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| InChIKey |
NIUGXMBTDKRJEE-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