General Information of the Compound
| Compound ID |
CP0036892
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| Compound Name |
4-(2-chlorophenyl)-8-(4-(dimethylamino)butyl)-9-hydroxypyrrolo[3,4-c]carbazole-1,3(2H,6H)-dione
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| Structure |
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| Formula |
C26H24ClN3O3
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| Molecular Weight |
461.949
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| Canonical SMILES |
CN(C)CCCCc1cc2[nH]c3cc(c4C(=O)NC(=O)c4c3c2cc1O)-c1ccccc1Cl
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| InChI |
InChI=1S/C26H24ClN3O3/c1-30(2)10-6-5-7-14-11-19-17(13-21(14)31)22-20(28-19)12-16(15-8-3-4-9-18(15)27)23-24(22)26(33)29-25(23)32/h3-4,8-9,11-13,28,31H,5-7,10H2,1-2H3,(H,29,32,33)
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| InChIKey |
CWXCDIQIRXEVOH-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