General Information of the Compound
| Compound ID |
CP0339771
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| Compound Name |
CHEMBL2392499
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| Formula |
C13H15N5O
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| Molecular Weight |
257.297
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| Canonical SMILES |
O[C@H]1CC[C@@H](CC1)n1nnc2cnc3[nH]ccc3c12
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| InChI |
InChI=1S/C13H15N5O/c19-9-3-1-8(2-4-9)18-12-10-5-6-14-13(10)15-7-11(12)16-17-18/h5-9,19H,1-4H2,(H,14,15)/t8-,9-
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| InChIKey |
RCVCCGGWXOBZLD-KYZUINATSA-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