General Information of the Compound
| Compound ID |
CP0543342
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| Compound Name |
3-[4-[5-methyl-3-(2-morpholin-4-ylpyridin-4-yl)-1H-pyrazol-4-yl]phenyl]benzenesulfonamide
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| Structure |
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| Formula |
C25H25N5O3S
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| Molecular Weight |
475.574
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| Canonical SMILES |
Cc1[nH]nc(c1-c1ccc(cc1)-c1cccc(c1)S(N)(=O)=O)-c1ccnc(c1)N1CCOCC1
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| InChI |
InChI=1S/C25H25N5O3S/c1-17-24(19-7-5-18(6-8-19)20-3-2-4-22(15-20)34(26,31)32)25(29-28-17)21-9-10-27-23(16-21)30-11-13-33-14-12-30/h2-10,15-16H,11-14H2,1H3,(H,28,29)(H2,26,31,32)
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| InChIKey |
KDJOKPCNVMCTCD-UHFFFAOYSA-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