General Information of the Compound
| Compound ID |
CP0463379
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| Compound Name |
1-Methyl-2-nitro-naphtho[2,1-b]furan
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| Structure |
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| Formula |
C13H9NO3
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| Molecular Weight |
227.219
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| Canonical SMILES |
Cc1c(oc2ccc3ccccc3c12)[N+]([O-])=O
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| InChI |
InChI=1S/C13H9NO3/c1-8-12-10-5-3-2-4-9(10)6-7-11(12)17-13(8)14(15)16/h2-7H,1H3
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| InChIKey |
CVUUOLKFENQCEZ-UHFFFAOYSA-N
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| CAS |
86539-67-5
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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