General Information of the Compound
| Compound ID |
CP0494268
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| Compound Name |
12,14-dimethyl-9-(5-methylfuran-2-yl)-8-nitroso-17-phenyl-1,8,12,14-tetrazatetracyclo[8.7.0.02,7.011,16]heptadeca-2,4,6,10,16-pentaene-13,15-dione
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| Structure |
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| Formula |
C26H21N5O4
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| Molecular Weight |
467.485
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| Canonical SMILES |
Cc1ccc(o1)C1N(N=O)c2ccccc2-n2c1c1n(C)c(=O)n(C)c(=O)c1c2-c1ccccc1
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| InChI |
InChI=1S/C26H21N5O4/c1-15-13-14-19(35-15)22-24-23-20(25(32)29(3)26(33)28(23)2)21(16-9-5-4-6-10-16)30(24)17-11-7-8-12-18(17)31(22)27-34/h4-14,22H,1-3H3
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| InChIKey |
NCYBVCIDTOWOQC-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