General Information of the Compound
| Compound ID |
CP0393158
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| Compound Name |
1-(3-chlorophenyl)sulfonyl-4-piperazin-1-ylindole-5-carbonitrile
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| Structure |
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| Formula |
C19H17ClN4O2S
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| Molecular Weight |
400.891
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| Canonical SMILES |
Clc1cccc(c1)S(=O)(=O)n1ccc2c(N3CCNCC3)c(ccc12)C#N
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| InChI |
InChI=1S/C19H17ClN4O2S/c20-15-2-1-3-16(12-15)27(25,26)24-9-6-17-18(24)5-4-14(13-21)19(17)23-10-7-22-8-11-23/h1-6,9,12,22H,7-8,10-11H2
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| InChIKey |
UHNQCIMNUOOBKH-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