General Information of the Compound
| Compound ID |
CP0885778
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| Compound Name |
SID4262870
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| Structure |
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| Formula |
C17H16ClFN2O
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| Molecular Weight |
318.779
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| Canonical SMILES |
O=C(c1cccc(F)c1)N1CCN(c2cccc(Cl)c2)CC1
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| InChI |
InChI=1S/C17H16ClFN2O/c18-14-4-2-6-16(12-14)20-7-9-21(10-8-20)17(22)13-3-1-5-15(19)11-13/h1-6,11-12H,7-10H2
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| InChIKey |
HYGDONULCUPJME-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