General Information of the Compound
| Compound ID |
CP0857456
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| Compound Name |
cis-(1R,2S)-2-(3-(3-Chlorophenethyl)-2,4,6-trioxotetrahydropyrimidin-1(2H)-yl)cyclopentyl acetate
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| Structure |
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| Formula |
C19H21ClN2O5
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| Molecular Weight |
392.839
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| Canonical SMILES |
CC(=O)O[C@@H]1CCC[C@@H]1N1C(=O)CC(=O)N(CCc2cccc(Cl)c2)C1=O
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| InChI |
InChI=1S/C19H21ClN2O5/c1-12(23)27-16-7-3-6-15(16)22-18(25)11-17(24)21(19(22)26)9-8-13-4-2-5-14(20)10-13/h2,4-5,10,15-16H,3,6-9,11H2,1H3/t15-,16+/m0/s1
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| InChIKey |
SYLGZJOGNOSQOG-JKSUJKDBSA-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