Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

962748 - Overview - Compound Synopsis

Synonyms
F9K
Molecular Formula
C42H51F2N7O9S
InChI
InChI=1S/C42H51F2N7O9S/c1-3-26-21-42(26)40(56)48-61(58,59)35-19-27(43)15-16-32(35)45-17-8-6-4-5-7-14-33(46-36(52)29-12-10-18-49(2)38(29)54)39(55)51-23-28(20-34(51)37(53)47-42)60-41(57)50-22-25-11-9-13-31(44)30(25)24-50/h3,9,11,13,15-16,19,26,28-29,33-34,45H,1,4-8,10,12,14,17-18,20-24H2,2H3,(H,46,52)(H,47,53)(H,48,56)/t26-,28-,29+,33+,34+,42-/m1/s1
Smiles
C=CC1CC12NC(=O)C1CC(OC(=O)N3Cc4cccc(F)c4C3)CN1C(=O)C(NC(=O)C1CCCN(C)C1=O)CCCCCCCNc1ccc(F)cc1S(=O)(=O)NC2=O
Cross References
UniChem82237597
canSAR962748
PDBe (Protein Data Bank Europe)F9K
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 867.3437036523.0718416112No


Compounds with the same scaffold


Image of compound ID: 962748
Murko Scaffold Family: 1 compoundsClick here to open a new canSAR search with these compounds

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