General Information of the Compound
| Compound ID |
CP0521199
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| Compound Name |
6-(8,9-dimethylpyrazolo[3,4-h]quinazolin-4-yl)-2-oxa-6-azaspiro[3.3]heptane
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| Structure |
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| Formula |
C16H17N5O
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| Molecular Weight |
295.346
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| Canonical SMILES |
Cc1n(C)nc2ccc3c(ncnc3c12)N1CC2(COC2)C1
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| InChI |
InChI=1S/C16H17N5O/c1-10-13-12(19-20(10)2)4-3-11-14(13)17-9-18-15(11)21-5-16(6-21)7-22-8-16/h3-4,9H,5-8H2,1-2H3
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| InChIKey |
YCSMGUHVCGBSKV-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