General Information of the Compound
| Compound ID |
CP0458446
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| Compound Name |
(4-pyridin-3-ylpiperazin-1-yl)-[4-(tetrazolo[1,5-a]quinoxalin-4-ylamino)phenyl]methanone
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| Structure |
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| Formula |
C24H21N9O
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| Molecular Weight |
451.494
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| Canonical SMILES |
O=C(N1CCN(CC1)c1cccnc1)c1ccc(Nc2nc3ccccc3n3nnnc23)cc1
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| InChI |
InChI=1S/C24H21N9O/c34-24(32-14-12-31(13-15-32)19-4-3-11-25-16-19)17-7-9-18(10-8-17)26-22-23-28-29-30-33(23)21-6-2-1-5-20(21)27-22/h1-11,16H,12-15H2,(H,26,27)
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| InChIKey |
ARWZMXSVUCOHTL-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