General Information of the Compound
| Compound ID |
CP0493656
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| Compound Name |
1-(Cyclopropylamino)-4-(2,2-dioxido-3-phenyl-2,1,3-benzothiadiazol-1(3H)-yl)butan-2-ol
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| Structure |
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| Formula |
C19H23N3O3S
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| Molecular Weight |
373.478
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| Canonical SMILES |
OC(CCN1c2ccccc2N(c2ccccc2)S1(=O)=O)CNC1CC1
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| InChI |
InChI=1S/C19H23N3O3S/c23-17(14-20-15-10-11-15)12-13-21-18-8-4-5-9-19(18)22(26(21,24)25)16-6-2-1-3-7-16/h1-9,15,17,20,23H,10-14H2
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| InChIKey |
AZFGCYKKRIPXTL-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