General Information of the Compound
| Compound ID |
CP0923783
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| Compound Name |
SID56463714
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| Structure |
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| Formula |
C21H26FN3
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| Molecular Weight |
339.458
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| Canonical SMILES |
CC(C)C[C@H]1CN=C(Nc2ccccc2)N1CCc1ccc(F)cc1
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| InChI |
InChI=1S/C21H26FN3/c1-16(2)14-20-15-23-21(24-19-6-4-3-5-7-19)25(20)13-12-17-8-10-18(22)11-9-17/h3-11,16,20H,12-15H2,1-2H3,(H,23,24)/t20-/m0/s1
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| InChIKey |
HCXMEOJYOSXYAZ-FQEVSTJZSA-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: PT06172, Mothers against decapentaplegic homolog 3