General Information of the Compound
| Compound ID |
CP0902565
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| Compound Name |
((2-ethoxy-4-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)benzamido)methyl)phosphonic acid
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| Structure |
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| Formula |
C27H39N4O10P
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| Molecular Weight |
610.601
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2ccc(C(=O)NCP(=O)(O)O)c(OCC)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C27H39N4O10P/c1-4-7-8-9-19(21(5-2)31(36)17-32)25(33)28-15-29-27(35)23-13-12-22(41-23)18-10-11-20(24(14-18)40-6-3)26(34)30-16-42(37,38)39/h10-14,17,19,21,36H,4-9,15-16H2,1-3H3,(H,28,33)(H,29,35)(H,30,34)(H2,37,38,39)/t19-,21-/m1/s1
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| InChIKey |
RGWOWRVQVVNBOO-TZIWHRDSSA-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
Protein ID: PT04609, Tolloid-like protein 1
Protein ID: PT06770, Tolloid-like protein 2