General Information of the Compound
| Compound ID |
CP0736361
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| Compound Name |
SID4242957
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| Formula |
C18H21N5O2
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| Molecular Weight |
339.399
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| Canonical SMILES |
CC1=Nc2ncnn2C(c2cccnc2)/C1=C(\O)OC1CCCCC1
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| InChI |
InChI=1S/C18H21N5O2/c1-12-15(17(24)25-14-7-3-2-4-8-14)16(13-6-5-9-19-10-13)23-18(22-12)20-11-21-23/h5-6,9-11,14,16,24H,2-4,7-8H2,1H3/b17-15+
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| InChIKey |
MJFQQSNRQAJFKJ-BMRADRMJSA-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