The Biofilms Structural Database
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The Biofilms Structural Database |
Antagonist 18 |
|
|---|---|
6Z5K |
|
Code
QAE | |
|
Name |
6-chloranyl-3-[(2-pentyl-2,3-dihydro-1,3-thiazol-4-yl)methyl]quinazolin-4-one |
|
Molecular Weight |
347.86 |
|
Isomeric SMILES |
CCCCCc1nc(cs1)CN2C=Nc3ccc(cc3C2=O)Cl |
|
Formula |
C17H18ClN3OS |
|
Identifiers |
6-chloranyl-3-[(2-pentyl-1,3-thiazol-4-yl)methyl]quinazolin-4-one |
|
Formal Charge |
0 |
|
InChI |
InChI=1S/C17H18ClN3OS/c1-2-3-4-5-16-20-13(10-23-16)9-21-11-19-15-7-6-12(18)8-14(15)17(21)22/h6-8,10-11H,2-5,9H2,1H3 |
|
Atom Count |
41 |
|
InChIKey |
NHLFNYUFUYOOKX-UHFFFAOYSA-N |
|
PDB codes |
6Z5K |
|
Type |
NON-POLYMER |
|
Chiral Atom Count |
0 |
|
Chiral Atoms |
n/a |
|
Bond Count |
43 |
|
Aromatic Bond Count |
11 |
|
Leaving Atoms |
n/a |