General Information of the Compound
| Compound ID |
CP0417831
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| Compound Name |
1-(naphthalene-1-sulfonyl)-N-(piperidin-4-ylmethyl)-1H-indazol-6-amine
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| Structure |
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| Formula |
C23H24N4O2S
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| Molecular Weight |
420.538
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| Canonical SMILES |
O=S(=O)(c1cccc2ccccc12)n1ncc2ccc(NCC3CCNCC3)cc12
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| InChI |
InChI=1S/C23H24N4O2S/c28-30(29,23-7-3-5-18-4-1-2-6-21(18)23)27-22-14-20(9-8-19(22)16-26-27)25-15-17-10-12-24-13-11-17/h1-9,14,16-17,24-25H,10-13,15H2
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| InChIKey |
RBQOGDHSDMIBCS-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