General Information of the Compound
| Compound ID |
CP0564121
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| Compound Name |
(8-methoxy-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-(3-phenyl-1H-pyrazol-5-yl)methanone
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| Formula |
C22H20N4O2
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| Molecular Weight |
372.428
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| Canonical SMILES |
COc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)c1cc([nH]n1)-c1ccccc1
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| InChI |
InChI=1S/C22H20N4O2/c1-28-15-7-8-18-16(11-15)17-13-26(10-9-19(17)23-18)22(27)21-12-20(24-25-21)14-5-3-2-4-6-14/h2-8,11-12,23H,9-10,13H2,1H3,(H,24,25)
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| InChIKey |
NXOUVZRPQAICQD-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