General Information of the Compound
| Compound ID |
CP0510495
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| Compound Name |
1,2,3,7,8,11a-Hexahydro-6,9,11-trioxa-3a-aza-cyclopenta[b]anthracen-4-one
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| Structure |
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| Formula |
C13H13NO4
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| Molecular Weight |
247.25
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| Canonical SMILES |
O=C1N2CCCC2Oc2cc3OCCOc3cc12
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| InChI |
InChI=1S/C13H13NO4/c15-13-8-6-10-11(17-5-4-16-10)7-9(8)18-12-2-1-3-14(12)13/h6-7,12H,1-5H2
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| InChIKey |
RQEPVMAYUINZRE-UHFFFAOYSA-N
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| CAS |
191744-13-5
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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