General Information of the Compound
| Compound ID |
CP0867132
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| Compound Name |
N-(6,6-Dioxo-5,6-dihydro-6lambda6-thia-4,5-diaza-chrysen-12-yl)-N,N',N'-trimethyl-ethane-1,2-diamine
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| Structure |
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| Formula |
C20H22N4O2S
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| Molecular Weight |
382.489
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| Canonical SMILES |
CN(C)CCN(C)c1cc2c(c3ncccc13)NS(=O)(=O)c1ccccc1-2
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| InChI |
InChI=1S/C20H22N4O2S/c1-23(2)11-12-24(3)17-13-16-14-7-4-5-9-18(14)27(25,26)22-20(16)19-15(17)8-6-10-21-19/h4-10,13,22H,11-12H2,1-3H3
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| InChIKey |
UAMGBKYYIOOEEZ-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