![spacer](http://www.ebi.ac.uk/inc/images/spacer.gif) |
LZ8 : Summary
Code ![](/pdbe/static/images/help.png)
|
LZ8
|
One-letter code ![](/pdbe/static/images/help.png)
|
X
|
Molecule name ![](/pdbe/static/images/help.png)
|
N-(4-FLUOROPHENYL)-4-[(PHENYLCARBONYL)AMINO]-1H-PYRAZOLE-3-CARBOXAMIDE
|
Systematic names ![](/pdbe/static/images/help.png)
|
|
Formula ![](/pdbe/static/images/help.png)
|
C17 H13 F N4 O2
|
Formal charge ![](/pdbe/static/images/help.png)
|
0
|
Molecular weight ![](/pdbe/static/images/help.png)
|
324.309 Da
|
SMILES ![](/pdbe/static/images/help.png)
|
Type | Program | Version | Descriptor |
SMILES
|
ACDLabs |
10.04 |
O=C(Nc1c(nnc1)C(=O)Nc2ccc(F)cc2)c3ccccc3 |
SMILES
|
CACTVS |
3.352 |
Fc1ccc(NC(=O)c2n[nH]cc2NC(=O)c3ccccc3)cc1 |
SMILES
|
OpenEye OEToolkits |
1.6.1 |
c1ccc(cc1)C(=O)Nc2c[nH]nc2C(=O)Nc3ccc(cc3)F |
Canonical SMILES
|
CACTVS |
3.352 |
Fc1ccc(NC(=O)c2n[nH]cc2NC(=O)c3ccccc3)cc1 |
Canonical SMILES
|
OpenEye OEToolkits |
1.6.1 |
c1ccc(cc1)C(=O)Nc2c[nH]nc2C(=O)Nc3ccc(cc3)F |
|
IUPAC InChI ![](/pdbe/static/images/help.png) | InChI=1S/C17H13FN4O2/c18-12-6-8-13(9-7-12)20-17(24)15-14(10-19-22-15)21-16(23)11-4-2-1-3-5-11/h1-10H,(H,19,22)(H,20,24)(H,21,23) |
IUPAC InChI key ![](/pdbe/static/images/help.png) | ZMWYSLJBNJUCRK-UHFFFAOYSA-N |
|
wwPDB Information |
Atom count ![](/pdbe/static/images/help.png)
|
37 (24 without Hydrogen)
|
Polymer type ![](/pdbe/static/images/help.png)
|
Bound ligand
|
Type description ![](/pdbe/static/images/help.png)
|
non-polymer
|
Type code ![](/pdbe/static/images/help.png)
|
HETAIN
|
Is modified ![](/pdbe/static/images/help.png)
|
No
|
Standard parent ![](/pdbe/static/images/help.png)
|
Not Assigned
|
Defined at ![](/pdbe/static/images/help.png)
|
2008-05-15
|
Last modified at ![](/pdbe/static/images/help.png)
|
2011-06-04
|
Status ![](/pdbe/static/images/help.png)
|
Released
|
Obsoleted ![](/pdbe/static/images/help.png)
|
Not Assigned
|
|