General Information of the Compound
| Compound ID |
CP0403295
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| Compound Name |
(S)-1-(2-amino-2-carboxyethyl)-3-(tetrazol-5-ylmethyl)pyrimidine-2,4-dione
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| Structure |
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| Formula |
C9H11N7O4
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| Molecular Weight |
281.232
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| Canonical SMILES |
N[C@@H](Cn1ccc(=O)n(Cc2nnn[nH]2)c1=O)C(O)=O
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| InChI |
InChI=1S/C9H11N7O4/c10-5(8(18)19)3-15-2-1-7(17)16(9(15)20)4-6-11-13-14-12-6/h1-2,5H,3-4,10H2,(H,18,19)(H,11,12,13,14)/t5-/m0/s1
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| InChIKey |
GOCKVRMBGMNVKR-YFKPBYRVSA-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