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

1055134 - Overview - Compound Synopsis

Synonyms
T1C
Molecular Formula
C29H41N5O8+2
InChI
InChI=1S/C29H39N5O8/c1-28(2,3)31-11-17(35)32-15-10-16(33(4)5)13-8-12-9-14-21(34(6)7)24(38)20(27(30)41)26(40)29(14,42)25(39)18(12)23(37)19(13)22(15)36/h10,12,14,21,31,36,38-39,42H,8-9,11H2,1-7H3,(H2,30,41)(H,32,35)/p+2/t12-,14-,21-,29-/m0/s1
Smiles
C[NH+](C)c1cc(NC(=O)CNC(C)(C)C)c(O)c2c1CC1CC3C([NH+](C)C)C(O)=C(C(N)=O)C(=O)C3(O)C(O)=C1C2=O
Cross References
UniChem82237639
canSAR1055134
PDBe (Protein Data Bank Europe)T1C
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 587.29441611218-2.1939101383Yes


Compounds with the same scaffold


Image of compound ID: 1055134
Murko Scaffold Family: 312 compoundsClick here to open a new canSAR search with these compounds

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