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

1103616 - Overview - Compound Synopsis

Synonyms
1YH
Molecular Formula
C29H43N5O4
InChI
InChI=1S/C29H43N5O4/c1-19(30-2)27(35)32-26(20-9-4-3-5-10-20)29(37)34-17-21-11-8-15-33(21)18-24(34)28(36)31-23-14-16-38-25-13-7-6-12-22(23)25/h6-7,12-13,19-21,23-24,26,30H,3-5,8-11,14-18H2,1-2H3,(H,31,36)(H,32,35)/t19-,21+,23+,24-,26-/m0/s1
Smiles
CN[C@@H](C)C(=O)N[C@H](C(=O)N1C[C@H]2CCCN2C[C@H]1C(=O)N[C@@H]1CCOc2ccccc21)C1CCCCC1
Cross References
UniChem30440822
canSAR1103616
PDBe (Protein Data Bank Europe)1YH
ChEMBLCHEMBL2365533
BindingDB50425728
BindingDB50443811
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 525.3315048561.97463981No


Compounds with the same scaffold


Image of compound ID: 1103616
Murko Scaffold Family: 527 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12





Compound Lineages


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