General Information of the Compound
| Compound ID |
CP0529547
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| Compound Name |
4,7-bis[4-(4-methylpiperazin-1-yl)phenyl]pyrazino[1,2-a]benzimidazole
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| Structure |
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| Formula |
C32H35N7
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| Molecular Weight |
517.681
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| Canonical SMILES |
CN1CCN(CC1)c1ccc(cc1)-c1ccc2nc3cncc(-c4ccc(cc4)N4CCN(C)CC4)n3c2c1
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| InChI |
InChI=1S/C32H35N7/c1-35-13-17-37(18-14-35)27-8-3-24(4-9-27)26-7-12-29-30(21-26)39-31(22-33-23-32(39)34-29)25-5-10-28(11-6-25)38-19-15-36(2)16-20-38/h3-12,21-23H,13-20H2,1-2H3
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| InChIKey |
KQFFSSYWPVJGFN-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