General Information of the Compound
| Compound ID |
CP0886580
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| Compound Name |
SID24800064
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| Structure |
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| Formula |
C22H23N5O
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| Molecular Weight |
373.46
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| Canonical SMILES |
CN(CCc1cn[nH]c1)Cc1nc(C(c2ccccc2)c2ccccc2)no1
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| InChI |
InChI=1S/C22H23N5O/c1-27(13-12-17-14-23-24-15-17)16-20-25-22(26-28-20)21(18-8-4-2-5-9-18)19-10-6-3-7-11-19/h2-11,14-15,21H,12-13,16H2,1H3,(H,23,24)
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| InChIKey |
WFFZWQSPPINCKJ-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