General Information of the Compound
| Compound ID |
CP0883777
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| Compound Name |
6-(1-Butyl-pentyl)-2-(2,4-dichloro-phenyl)-4-methyl-7,8-dihydro-6H-1,3,6,8a-tetraaza-acenaphthylene
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| Structure |
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| Formula |
C24H30Cl2N4
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| Molecular Weight |
445.438
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| Canonical SMILES |
CCCCC(CCCC)N1CCn2nc(-c3ccc(Cl)cc3Cl)c3nc(C)cc1c32
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| InChI |
InChI=1S/C24H30Cl2N4/c1-4-6-8-18(9-7-5-2)29-12-13-30-24-21(29)14-16(3)27-23(24)22(28-30)19-11-10-17(25)15-20(19)26/h10-11,14-15,18H,4-9,12-13H2,1-3H3
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| InChIKey |
KUOPRESVWMTWCX-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