General Information of the Compound
| Compound ID |
CP0897727
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| Compound Name |
7-methyl-11-(4-methyl-piperazin-1-yl)-dibenzo[b,f][1,4]oxazepine
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| Structure |
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| Formula |
C19H21N3O
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| Molecular Weight |
307.397
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| Canonical SMILES |
Cc1ccc2c(c1)Oc1ccccc1C(N1CCN(C)CC1)=N2
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| InChI |
InChI=1S/C19H21N3O/c1-14-7-8-16-18(13-14)23-17-6-4-3-5-15(17)19(20-16)22-11-9-21(2)10-12-22/h3-8,13H,9-12H2,1-2H3
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| InChIKey |
BXSJZGNGSQXJPJ-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