General Information of the Compound
| Compound ID |
CP0439829
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| Compound Name |
benzyl N-[(1R)-2-(1H-indol-3-yl)-1-(5-phenyl-1H-imidazol-2-yl)ethyl]carbamate
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| Structure |
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| Formula |
C27H24N4O2
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| Molecular Weight |
436.515
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| Canonical SMILES |
O=C(N[C@H](Cc1c[nH]c2ccccc12)c1nc(c[nH]1)-c1ccccc1)OCc1ccccc1
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| InChI |
InChI=1S/C27H24N4O2/c32-27(33-18-19-9-3-1-4-10-19)31-24(15-21-16-28-23-14-8-7-13-22(21)23)26-29-17-25(30-26)20-11-5-2-6-12-20/h1-14,16-17,24,28H,15,18H2,(H,29,30)(H,31,32)/t24-/m1/s1
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| InChIKey |
UDRCVZGXOKQHJG-XMMPIXPASA-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