General Information of the Compound
| Compound ID |
CP0341353
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| Compound Name |
(S)-2-(2-(3-(2,6-dichlorophenyl)ureido)-2-naphthamido)succinic acid
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| Structure |
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| Formula |
C22H17Cl2N3O6
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| Molecular Weight |
490.299
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| Canonical SMILES |
OC(=O)C[C@H](NC(=O)c1cc2ccccc2cc1NC(=O)Nc1c(Cl)cccc1Cl)C(O)=O
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| InChI |
InChI=1S/C22H17Cl2N3O6/c23-14-6-3-7-15(24)19(14)27-22(33)26-16-9-12-5-2-1-4-11(12)8-13(16)20(30)25-17(21(31)32)10-18(28)29/h1-9,17H,10H2,(H,25,30)(H,28,29)(H,31,32)(H2,26,27,33)/t17-/m0/s1
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| InChIKey |
BWTSVKZIQSCLAT-KRWDZBQOSA-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