General Information of the Compound
| Compound ID |
CP0547562
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| Compound Name |
N-[[1-(6-fluoronaphthalen-1-yl)cyclopropyl]methyl]-4-methoxy-3-(4-methylpiperazin-1-yl)benzenesulfonamide
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| Structure |
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| Formula |
C26H30FN3O3S
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| Molecular Weight |
483.609
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| Canonical SMILES |
COc1ccc(cc1N1CCN(C)CC1)S(=O)(=O)NCC1(CC1)c1cccc2cc(F)ccc12
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| InChI |
InChI=1S/C26H30FN3O3S/c1-29-12-14-30(15-13-29)24-17-21(7-9-25(24)33-2)34(31,32)28-18-26(10-11-26)23-5-3-4-19-16-20(27)6-8-22(19)23/h3-9,16-17,28H,10-15,18H2,1-2H3
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| InChIKey |
HTGLMPYKJGMLJD-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