General Information of the Compound
| Compound ID |
CP0403534
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| Compound Name |
1-[6-(3-cyclopentylpropyl)pyridin-2-yl]-N-phenyl-2,3-dihydro-1H-indole-5-sulfonamide
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| Structure |
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| Formula |
C27H31N3O2S
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| Molecular Weight |
461.631
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| Canonical SMILES |
O=S(=O)(Nc1ccccc1)c1ccc2N(CCc2c1)c1cccc(CCCC2CCCC2)n1
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| InChI |
InChI=1S/C27H31N3O2S/c31-33(32,29-24-11-2-1-3-12-24)25-16-17-26-22(20-25)18-19-30(26)27-15-7-14-23(28-27)13-6-10-21-8-4-5-9-21/h1-3,7,11-12,14-17,20-21,29H,4-6,8-10,13,18-19H2
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| InChIKey |
KJBYOLPMFLIWTF-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: PT01179, Beta-1 adrenergic receptor
Protein ID: PT01494, Beta-2 adrenergic receptor
Protein ID: PT01493, Beta-3 adrenergic receptor