General Information of the Compound
| Compound ID |
CP0579610
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| Compound Name |
2-amino-N-[(1R)-1-cyclopropyl-2-hydroxyethyl]-5-[7-(difluoromethoxy)-1-oxo-2-[(2S)-1,1,1-trifluoropropan-2-yl]-3H-isoindol-5-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
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| Structure |
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| Formula |
C24H23F5N6O4
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| Molecular Weight |
554.476
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| Canonical SMILES |
C[C@H](N1Cc2cc(cc(OC(F)F)c2C1=O)-c1ccn2nc(N)c(C(=O)N[C@@H](CO)C3CC3)c2n1)C(F)(F)F
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| InChI |
InChI=1S/C24H23F5N6O4/c1-10(24(27,28)29)34-8-13-6-12(7-16(39-23(25)26)17(13)22(34)38)14-4-5-35-20(31-14)18(19(30)33-35)21(37)32-15(9-36)11-2-3-11/h4-7,10-11,15,23,36H,2-3,8-9H2,1H3,(H2,30,33)(H,32,37)/t10-,15-/m0/s1
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| InChIKey |
LZQMQCKFXBUAPA-BONVTDFDSA-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