Chemical Components in the PDB

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LVP : Summary

Code

LVP

One-letter code

X

Molecule name

~{N}'-(2-fluorophenyl)-1,2-oxazole-5-carbohydrazide

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.6 ~{N}'-(2-fluorophenyl)-1,2-oxazole-5-carbohydrazide

Formula

C10 H8 F N3 O2

Formal charge

0

Molecular weight

221.188 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 Fc1ccccc1NNC(=O)c2oncc2
SMILES OpenEye OEToolkits 2.0.6 c1ccc(c(c1)NNC(=O)c2ccno2)F
Canonical SMILES CACTVS 3.385 Fc1ccccc1NNC(=O)c2oncc2
Canonical SMILES OpenEye OEToolkits 2.0.6 c1ccc(c(c1)NNC(=O)c2ccno2)F

IUPAC InChI

InChI=1S/C10H8FN3O2/c11-7-3-1-2-4-8(7)13-14-10(15)9-5-6-12-16-9/h1-6,13H,(H,14,15)

IUPAC InChI key

WLARYWMNUKSZGW-UHFFFAOYSA-N
LVP

wwPDB Information

Atom count

24 (16 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2019-03-15

Last modified at

2020-04-24

Status

Released

Obsoleted

Not Assigned