General Information of the Compound
| Compound ID |
CP0339824
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| Compound Name |
Benzyl-(8-methoxy-10,11-dihydro-5-oxa-2,4,11-triaza-dibenzo[a,d]cyclohepten-1-yl)-amine
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| Structure |
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| Formula |
C19H18N4O2
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| Molecular Weight |
334.379
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| Canonical SMILES |
COc1ccc2Oc3ncnc(NCc4ccccc4)c3NCc2c1
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| InChI |
InChI=1S/C19H18N4O2/c1-24-15-7-8-16-14(9-15)11-20-17-18(22-12-23-19(17)25-16)21-10-13-5-3-2-4-6-13/h2-9,12,20H,10-11H2,1H3,(H,21,22,23)
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| InChIKey |
GTJIBRAODDVZRM-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