General Information of the Compound
| Compound ID |
CP0534628
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| Compound Name |
N-[(1R,2S)-1-[1-(4-fluorophenyl)indazol-5-yl]oxy-1-phenylpropan-2-yl]butane-2-sulfonamide
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| Structure |
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| Formula |
C26H28FN3O3S
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| Molecular Weight |
481.593
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| Canonical SMILES |
CCC(C)S(=O)(=O)N[C@@H](C)[C@H](Oc1ccc2n(ncc2c1)-c1ccc(F)cc1)c1ccccc1
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| InChI |
InChI=1S/C26H28FN3O3S/c1-4-18(2)34(31,32)29-19(3)26(20-8-6-5-7-9-20)33-24-14-15-25-21(16-24)17-28-30(25)23-12-10-22(27)11-13-23/h5-19,26,29H,4H2,1-3H3/t18?,19-,26-/m0/s1
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| InChIKey |
QOQFHZCQTSLCMQ-BVIFZPFNSA-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