General Information of the Compound
| Compound ID |
CP0940964
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| Compound Name |
rac-1-(4-Chlorophenethyl)-3-(3-ethylcyclopentyl)pyrimidine-2,4,6(1H,3H,5H)-trione
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| Structure |
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| Formula |
C19H23ClN2O3
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| Molecular Weight |
362.857
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| Canonical SMILES |
CCC1CCC(N2C(=O)CC(=O)N(CCc3ccc(Cl)cc3)C2=O)C1
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| InChI |
InChI=1S/C19H23ClN2O3/c1-2-13-5-8-16(11-13)22-18(24)12-17(23)21(19(22)25)10-9-14-3-6-15(20)7-4-14/h3-4,6-7,13,16H,2,5,8-12H2,1H3
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| InChIKey |
YHWWPYUITXNAKW-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