General Information of the Compound
| Compound ID |
CP0964019
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| Compound Name |
(6,6-Dioxo-5,6-dihydro-6lambda6-thia-4,5-diaza-chrysen-12-yl)-morpholin-4-yl-methanone
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| Structure |
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| Formula |
C20H17N3O4S
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| Molecular Weight |
395.44
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| Canonical SMILES |
O=C(c1cc2c(c3ncccc13)NS(=O)(=O)c1ccccc1-2)N1CCOCC1
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| InChI |
InChI=1S/C20H17N3O4S/c24-20(23-8-10-27-11-9-23)16-12-15-13-4-1-2-6-17(13)28(25,26)22-19(15)18-14(16)5-3-7-21-18/h1-7,12,22H,8-11H2
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| InChIKey |
JXZKMEFGSBDXJC-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