General Information of the Compound
| Compound ID |
CP0334376
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| Compound Name |
CHEMBL2152415
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| Formula |
C14H17N5
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| Molecular Weight |
255.325
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| Canonical SMILES |
N[C@H]1CC[C@H](CC1)n1cnc2cnc3[nH]ccc3c12
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| InChI |
InChI=1S/C14H17N5/c15-9-1-3-10(4-2-9)19-8-18-12-7-17-14-11(13(12)19)5-6-16-14/h5-10H,1-4,15H2,(H,16,17)/t9-,10+
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| InChIKey |
YWFKBVSIOXRKIU-AOOOYVTPSA-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