General Information of the Compound
| Compound ID |
CP0860313
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| Compound Name |
[(2-Chloro-5-nitro-phenyl)-hydroxy-methyl]-phosphonic acid
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| Structure |
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| Formula |
C7H7ClNO6P
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| Molecular Weight |
267.561
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| Canonical SMILES |
O=[N+]([O-])c1ccc(Cl)c(C(O)P(=O)(O)O)c1
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| InChI |
InChI=1S/C7H7ClNO6P/c8-6-2-1-4(9(11)12)3-5(6)7(10)16(13,14)15/h1-3,7,10H,(H2,13,14,15)
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| InChIKey |
CTFNSDJMOQWGEW-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