General Information of the Compound
| Compound ID |
CP0443998
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| Compound Name |
3-[3-phenyl-2-[2-(propan-2-ylamino)acetyl]-3,4-dihydropyrazol-5-yl]chromen-2-one
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| Structure |
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| Formula |
C23H23N3O3
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| Molecular Weight |
389.455
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| Canonical SMILES |
CC(C)NCC(=O)N1N=C(CC1c1ccccc1)c1cc2ccccc2oc1=O
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| InChI |
InChI=1S/C23H23N3O3/c1-15(2)24-14-22(27)26-20(16-8-4-3-5-9-16)13-19(25-26)18-12-17-10-6-7-11-21(17)29-23(18)28/h3-12,15,20,24H,13-14H2,1-2H3
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| InChIKey |
UBROJUQBKFFRKJ-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