General Information of the Compound
| Compound ID |
CP0467137
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| Compound Name |
2-[[(2S)-3-(1H-indol-3-yl)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxopropan-2-yl]carbamoyloxy]acetic acid
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| Structure |
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| Formula |
C24H24N4O5
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| Molecular Weight |
448.479
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| Canonical SMILES |
OC(=O)COC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCCc1c[nH]c2ccccc12
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| InChI |
InChI=1S/C24H24N4O5/c29-22(30)14-33-24(32)28-21(11-16-13-27-20-8-4-2-6-18(16)20)23(31)25-10-9-15-12-26-19-7-3-1-5-17(15)19/h1-8,12-13,21,26-27H,9-11,14H2,(H,25,31)(H,28,32)(H,29,30)/t21-/m0/s1
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| InChIKey |
MHOAWSFMPMAKIO-NRFANRHFSA-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