General Information of the Compound
| Compound ID |
CP0079526
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| Compound Name |
CHEMBL2152413
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| Formula |
C19H25N5O2
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| Molecular Weight |
355.442
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| Canonical SMILES |
CC(C)(C)OC(=O)N[C@H]1CC[C@H](CC1)n1cnc2cnc3[nH]ccc3c12
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| InChI |
InChI=1S/C19H25N5O2/c1-19(2,3)26-18(25)23-12-4-6-13(7-5-12)24-11-22-15-10-21-17-14(16(15)24)8-9-20-17/h8-13H,4-7H2,1-3H3,(H,20,21)(H,23,25)/t12-,13+
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| InChIKey |
VBEGYGRCLFKGNY-BETUJISGSA-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