General Information of the Compound
| Compound ID |
CP0878695
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| Compound Name |
(((3-ethoxy-5-(5-((((R)-2-((R)-1-(N-hydroxyformamido)propyl)heptanamido)methyl)carbamoyl)furan-2-yl)phenyl)(hydroxy)phosphoryl)oxy)methyl isopropyl carbonate
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| Structure |
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| Formula |
C30H44N3O12P
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| Molecular Weight |
669.665
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| Canonical SMILES |
CCCCC[C@@H](C(=O)NCNC(=O)c1ccc(-c2cc(OCC)cc(P(=O)(O)OCOC(=O)OC(C)C)c2)o1)[C@@H](CC)N(O)C=O
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| InChI |
InChI=1S/C30H44N3O12P/c1-6-9-10-11-24(25(7-2)33(38)18-34)28(35)31-17-32-29(36)27-13-12-26(45-27)21-14-22(41-8-3)16-23(15-21)46(39,40)43-19-42-30(37)44-20(4)5/h12-16,18,20,24-25,38H,6-11,17,19H2,1-5H3,(H,31,35)(H,32,36)(H,39,40)/t24-,25-/m1/s1
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| InChIKey |
YZRLOQXLIIZRDE-JWQCQUIFSA-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