General Information of the Compound
| Compound ID |
CP0412197
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| Compound Name |
2-[4-(dimethylamino)phenyl]-N-[1-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyrazol-3-yl]acetamide
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| Structure |
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| Formula |
C24H27N5O2
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| Molecular Weight |
417.513
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| Canonical SMILES |
CN(C)c1ccc(CC(=O)Nc2ccn(Cc3ccc(cc3)N3CCCC3=O)n2)cc1
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| InChI |
InChI=1S/C24H27N5O2/c1-27(2)20-9-5-18(6-10-20)16-23(30)25-22-13-15-28(26-22)17-19-7-11-21(12-8-19)29-14-3-4-24(29)31/h5-13,15H,3-4,14,16-17H2,1-2H3,(H,25,26,30)
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| InChIKey |
ZNJXWHLHXANHJR-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
Protein ID: PT03095, Voltage-dependent T-type calcium channel subunit alpha-1G
Protein ID: PT04557, Voltage-dependent T-type calcium channel subunit alpha-1H
Protein ID: PT02881, Voltage-dependent T-type calcium channel subunit alpha-1I