General Information of the Compound
| Compound ID |
CP0455404
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| Compound Name |
4-[(1S,3S)-3-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]-2,2-dimethylcyclopropyl]benzenesulfonamide
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| Structure |
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| Formula |
C19H18FN3O3S
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| Molecular Weight |
387.436
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| Canonical SMILES |
CC1(C)[C@H]([C@@H]1c1ccc(cc1)S(N)(=O)=O)c1noc(n1)-c1ccc(F)cc1
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| InChI |
InChI=1S/C19H18FN3O3S/c1-19(2)15(11-5-9-14(10-6-11)27(21,24)25)16(19)17-22-18(26-23-17)12-3-7-13(20)8-4-12/h3-10,15-16H,1-2H3,(H2,21,24,25)/t15-,16+/m0/s1
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| InChIKey |
JOIPVKADAABUBT-JKSUJKDBSA-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