General Information of the Compound
| Compound ID |
CP0554518
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| Compound Name |
N-phenyl-4,6-dioxa-11,12-diazatetracyclo[7.6.0.03,7.010,14]pentadeca-1,3(7),8,10(14),12-pentaen-13-amine
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| Structure |
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| Formula |
C17H13N3O2
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| Molecular Weight |
291.31
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| Canonical SMILES |
C1Oc2cc3Cc4c(Nc5ccccc5)[nH]nc4-c3cc2O1
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| InChI |
InChI=1S/C17H13N3O2/c1-2-4-11(5-3-1)18-17-13-6-10-7-14-15(22-9-21-14)8-12(10)16(13)19-20-17/h1-5,7-8H,6,9H2,(H2,18,19,20)
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| InChIKey |
UMMHERUASLETGN-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