General Information of the Compound
| Compound ID |
CP0575489
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| Compound Name |
1-[5-(dimethylamino)naphthalen-1-yl]sulfonyl-3-(1,2,3,5,6,7-hexahydro-s-indacen-4-yl)urea
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| Structure |
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| Formula |
C25H27N3O3S
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| Molecular Weight |
449.576
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| Canonical SMILES |
CN(C)c1cccc2c(cccc12)S(=O)(=O)NC(=O)Nc1c2CCCc2cc2CCCc12
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| InChI |
InChI=1S/C25H27N3O3S/c1-28(2)22-13-5-12-21-20(22)11-6-14-23(21)32(30,31)27-25(29)26-24-18-9-3-7-16(18)15-17-8-4-10-19(17)24/h5-6,11-15H,3-4,7-10H2,1-2H3,(H2,26,27,29)
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| InChIKey |
NUYYIXUIGNZRAZ-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