General Information of the Compound
| Compound ID |
CP0497816
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| Compound Name |
3-(6-Benzoylamino-1,2,3,4-tetrahydro-carbazol-9-yl)-propionic acid
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| Structure |
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| Formula |
C22H22N2O3
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| Molecular Weight |
362.429
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| Canonical SMILES |
OC(=O)CCn1c2CCCCc2c2cc(NC(=O)c3ccccc3)ccc12
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| InChI |
InChI=1S/C22H22N2O3/c25-21(26)12-13-24-19-9-5-4-8-17(19)18-14-16(10-11-20(18)24)23-22(27)15-6-2-1-3-7-15/h1-3,6-7,10-11,14H,4-5,8-9,12-13H2,(H,23,27)(H,25,26)
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| InChIKey |
FIZJRVZJHIYCLM-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