General Information of the Compound
| Compound ID |
CP0378976
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| Compound Name |
(4-(2-(2,6-dichlorophenylamino)thiazolo[5,4-d]pyrimidin-7-ylamino)phenyl)(pyrrolidin-1-yl)methanone
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| Structure |
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| Formula |
C22H18Cl2N6OS
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| Molecular Weight |
485.4
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| Canonical SMILES |
Clc1cccc(Cl)c1Nc1nc2c(Nc3ccc(cc3)C(=O)N3CCCC3)ncnc2s1
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| InChI |
InChI=1S/C22H18Cl2N6OS/c23-15-4-3-5-16(24)17(15)28-22-29-18-19(25-12-26-20(18)32-22)27-14-8-6-13(7-9-14)21(31)30-10-1-2-11-30/h3-9,12H,1-2,10-11H2,(H,28,29)(H,25,26,27)
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| InChIKey |
WLTJDPRVHGCSPB-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
Protein ID: PT01914, Transient receptor potential cation channel subfamily V member 1
Protein ID: PT02183, Transient receptor potential cation channel subfamily V member 1