General Information of the Compound
| Compound ID |
CP0876355
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| Compound Name |
1-(3-chlorophenethyl)-3-(pentan-3-yl)pyrimidine-2,4,6(1H,3H,5H)-trione
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| Structure |
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| Formula |
C17H21ClN2O3
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| Molecular Weight |
336.819
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| Canonical SMILES |
CCC(CC)N1C(=O)CC(=O)N(CCc2cccc(Cl)c2)C1=O
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| InChI |
InChI=1S/C17H21ClN2O3/c1-3-14(4-2)20-16(22)11-15(21)19(17(20)23)9-8-12-6-5-7-13(18)10-12/h5-7,10,14H,3-4,8-9,11H2,1-2H3
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| InChIKey |
VOCWMPONAVHRBP-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: PT06040, Voltage-dependent L-type calcium channel subunit alpha-1C
Protein ID: PT06039, Voltage-dependent L-type calcium channel subunit alpha-1D