General Information of the Compound
| Compound ID |
CP0240918
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| Compound Name |
N-[(1R,2S)-1-[1-[1-(cyclopropylmethyl)-6-oxopyridin-3-yl]indazol-5-yl]oxy-1-phenylpropan-2-yl]-2,2-difluoropropanamide
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| Structure |
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| Formula |
C28H28F2N4O3
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| Molecular Weight |
506.553
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| Canonical SMILES |
C[C@H](NC(=O)C(C)(F)F)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(=O)n(CC2CC2)c1)c1ccccc1
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| InChI |
InChI=1S/C28H28F2N4O3/c1-18(32-27(36)28(2,29)30)26(20-6-4-3-5-7-20)37-23-11-12-24-21(14-23)15-31-34(24)22-10-13-25(35)33(17-22)16-19-8-9-19/h3-7,10-15,17-19,26H,8-9,16H2,1-2H3,(H,32,36)/t18-,26-/m0/s1
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| InChIKey |
KARDSHKKBLFUKZ-QYBDOPJKSA-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