General Information of the Compound
| Compound ID |
CP0535263
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| Compound Name |
N-[4-[2-[[(2S)-2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]phenyl]-2,3-dihydro-1H-indole-5-sulfonamide
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| Structure |
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| Formula |
C25H29N3O5S
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| Molecular Weight |
483.59
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| Canonical SMILES |
O[C@@H](CNCCc1ccc(NS(=O)(=O)c2ccc3NCCc3c2)cc1)COc1ccc(O)cc1
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| InChI |
InChI=1S/C25H29N3O5S/c29-21-5-7-23(8-6-21)33-17-22(30)16-26-13-11-18-1-3-20(4-2-18)28-34(31,32)24-9-10-25-19(15-24)12-14-27-25/h1-10,15,22,26-30H,11-14,16-17H2/t22-/m0/s1
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| InChIKey |
HLQSOZOEBJQGJG-QFIPXVFZSA-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