General Information of the Compound
| Compound ID |
CP0013374
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| Compound Name |
N-[(2S,3S)-3-amino-2-hydroxy-3-phenylpropyl]-3,4-dichloro-N-(oxetan-3-yl)benzenesulfonamide
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| Formula |
C18H20Cl2N2O4S
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| Molecular Weight |
431.341
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| Canonical SMILES |
N[C@H]([C@@H](O)CN(C1COC1)S(=O)(=O)c1ccc(Cl)c(Cl)c1)c1ccccc1
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| InChI |
InChI=1S/C18H20Cl2N2O4S/c19-15-7-6-14(8-16(15)20)27(24,25)22(13-10-26-11-13)9-17(23)18(21)12-4-2-1-3-5-12/h1-8,13,17-18,23H,9-11,21H2/t17-,18-/m0/s1
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| InChIKey |
DOGJGYGQVXVFTC-ROUUACIJSA-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