General Information of the Compound
| Compound ID |
CP0578871
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| Compound Name |
1-ethyl-1-[(1R)-1-[3-(8-methoxyimidazo[1,2-a]pyrazin-6-yl)phenyl]ethyl]-3-[1,1,1-trifluoro-3-(triazol-2-yl)propan-2-yl]urea
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| Formula |
C23H25F3N8O2
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| Molecular Weight |
502.501
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| Canonical SMILES |
CCN([C@H](C)c1cccc(c1)-c1cn2ccnc2c(OC)n1)C(=O)NC(Cn1nccn1)C(F)(F)F
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| InChI |
InChI=1S/C23H25F3N8O2/c1-4-33(22(35)31-19(23(24,25)26)14-34-28-8-9-29-34)15(2)16-6-5-7-17(12-16)18-13-32-11-10-27-20(32)21(30-18)36-3/h5-13,15,19H,4,14H2,1-3H3,(H,31,35)/t15-,19?/m1/s1
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| InChIKey |
DWZTZJYICKBFPW-NYRJJRHWSA-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