General Information of the Compound
| Compound ID |
CP0891551
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| Compound Name |
1-(3-Chlorophenethyl)-3-((1S,2S)-2-methoxycyclopentyl)pyrimidine-2,4,6(1H,3H,5H)-trione
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| Structure |
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| Formula |
C18H21ClN2O4
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| Molecular Weight |
364.829
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| Canonical SMILES |
CO[C@H]1CCC[C@@H]1N1C(=O)CC(=O)N(CCc2cccc(Cl)c2)C1=O
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| InChI |
InChI=1S/C18H21ClN2O4/c1-25-15-7-3-6-14(15)21-17(23)11-16(22)20(18(21)24)9-8-12-4-2-5-13(19)10-12/h2,4-5,10,14-15H,3,6-9,11H2,1H3/t14-,15-/m0/s1
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| InChIKey |
OKRMRZDQZISBQO-GJZGRUSLSA-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