General Information of the Compound
| Compound ID |
CP0487283
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| Compound Name |
3-methyl-5-(6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-4-yl)phenol
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| Structure |
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| Formula |
C20H18N4O3
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| Molecular Weight |
362.389
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| Canonical SMILES |
Cc1cc(O)cc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
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| InChI |
InChI=1S/C20H18N4O3/c1-12-9-13(11-14(25)10-12)18-22-16-15-3-2-4-21-20(15)27-17(16)19(23-18)24-5-7-26-8-6-24/h2-4,9-11,25H,5-8H2,1H3
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| InChIKey |
QPIVCTGDULLFRU-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