General Information of the Compound
| Compound ID |
CP0486296
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| Compound Name |
3-(1H-indol-3-yl)-2-[[(2-phenylacetyl)amino]carbamoylamino]-N-(2-phenylethyl)propanamide
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| Structure |
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| Formula |
C28H29N5O3
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| Molecular Weight |
483.572
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| Canonical SMILES |
O=C(Cc1ccccc1)NNC(=O)NC(Cc1c[nH]c2ccccc12)C(=O)NCCc1ccccc1
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| InChI |
InChI=1S/C28H29N5O3/c34-26(17-21-11-5-2-6-12-21)32-33-28(36)31-25(18-22-19-30-24-14-8-7-13-23(22)24)27(35)29-16-15-20-9-3-1-4-10-20/h1-14,19,25,30H,15-18H2,(H,29,35)(H,32,34)(H2,31,33,36)
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| InChIKey |
NJNKMKAEZATWEJ-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