General Information of the Compound
| Compound ID |
CP0412329
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| Compound Name |
2-((((S)-3-amino-3-carboxypropyl)(hydroxy)phosphoryl)methyl)pentanedioic acid
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| Structure |
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| Formula |
C10H18NO8P
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| Molecular Weight |
311.227
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| Canonical SMILES |
N[C@@H](CCP(O)(=O)CC(CCC(O)=O)C(O)=O)C(O)=O
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| InChI |
InChI=1S/C10H18NO8P/c11-7(10(16)17)3-4-20(18,19)5-6(9(14)15)1-2-8(12)13/h6-7H,1-5,11H2,(H,12,13)(H,14,15)(H,16,17)(H,18,19)/t6?,7-/m0/s1
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| InChIKey |
YLHAQDFYEKJARV-MLWJPKLSSA-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