General Information of the Compound
| Compound ID |
CP0908775
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| Compound Name |
SID92764371
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| Structure |
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| Formula |
C17H18ClNO4
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| Molecular Weight |
335.787
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| Canonical SMILES |
CC(C)OC(=O)c1ccc(NCc2cc(O)ccc2O)cc1Cl
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| InChI |
InChI=1S/C17H18ClNO4/c1-10(2)23-17(22)14-5-3-12(8-15(14)18)19-9-11-7-13(20)4-6-16(11)21/h3-8,10,19-21H,9H2,1-2H3
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| InChIKey |
KYIFXDFKSZAPFG-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: PT06109, Geminin
Protein ID: PT02997, Isocitrate dehydrogenase [NADP] cytoplasmic
Protein ID: PT06101, Latent membrane protein 1