General Information of the Compound
| Compound ID |
CP0360943
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| Compound Name |
(S)-1-(3,4,5-trichloro-2-hydroxyphenylsulfonyl)pyrrolidine-2-carboxylic acid
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| Structure |
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| Formula |
C11H10Cl3NO5S
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| Molecular Weight |
374.629
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| Canonical SMILES |
OC(=O)[C@@H]1CCCN1S(=O)(=O)c1cc(Cl)c(Cl)c(Cl)c1O
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| InChI |
InChI=1S/C11H10Cl3NO5S/c12-5-4-7(10(16)9(14)8(5)13)21(19,20)15-3-1-2-6(15)11(17)18/h4,6,16H,1-3H2,(H,17,18)/t6-/m0/s1
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| InChIKey |
SMIZKRHOEQTUGE-LURJTMIESA-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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Table of Molecular Bioactivities Related to the Compound