General Information of the Compound
| Compound ID |
CP0870036
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| Compound Name |
((3-ethoxy-5-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)phenyl)phosphoryl)bis(oxy)bis(methylene) diacetate
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| Structure |
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| Formula |
C31H44N3O13P
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| Molecular Weight |
697.675
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2cc(OCC)cc(P(=O)(OCOC(C)=O)OCOC(C)=O)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C31H44N3O13P/c1-6-9-10-11-26(27(7-2)34(40)18-35)30(38)32-17-33-31(39)29-13-12-28(47-29)23-14-24(42-8-3)16-25(15-23)48(41,45-19-43-21(4)36)46-20-44-22(5)37/h12-16,18,26-27,40H,6-11,17,19-20H2,1-5H3,(H,32,38)(H,33,39)/t26-,27-/m1/s1
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| InChIKey |
DWWMNBWBWLGDNW-KAYWLYCHSA-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