General Information of the Compound
| Compound ID |
CP0578375
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| Compound Name |
1-(3-chlorophenyl)sulfonyl-N-[(3S)-oxolan-3-yl]pyrrolo[3,2-c]quinolin-4-amine
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| Structure |
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| Formula |
C21H18ClN3O3S
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| Molecular Weight |
427.913
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| Canonical SMILES |
Clc1cccc(c1)S(=O)(=O)n1ccc2c(N[C@H]3CCOC3)nc3ccccc3c12
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| InChI |
InChI=1S/C21H18ClN3O3S/c22-14-4-3-5-16(12-14)29(26,27)25-10-8-18-20(25)17-6-1-2-7-19(17)24-21(18)23-15-9-11-28-13-15/h1-8,10,12,15H,9,11,13H2,(H,23,24)/t15-/m0/s1
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| InChIKey |
KXYKGHPPJVXDFH-HNNXBMFYSA-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