General Information of the Compound
| Compound ID |
CP0931087
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| Compound Name |
diphenyl (3-ethoxy-5-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)phenyl)phosphonate
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| Structure |
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| Formula |
C37H44N3O9P
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| Molecular Weight |
705.745
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2cc(OCC)cc(P(=O)(Oc3ccccc3)Oc3ccccc3)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C37H44N3O9P/c1-4-7-10-19-32(33(5-2)40(44)26-41)36(42)38-25-39-37(43)35-21-20-34(47-35)27-22-30(46-6-3)24-31(23-27)50(45,48-28-15-11-8-12-16-28)49-29-17-13-9-14-18-29/h8-9,11-18,20-24,26,32-33,44H,4-7,10,19,25H2,1-3H3,(H,38,42)(H,39,43)/t32-,33-/m1/s1
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| InChIKey |
LVFDHYNQWNDSNV-CZNDPXEESA-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: PT01896, Bone morphogenetic protein 1
Protein ID: PT04609, Tolloid-like protein 1
Protein ID: PT06770, Tolloid-like protein 2