Chemical Components in the PDB

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TVW : Summary

Code

TVW

One-letter code

X

Molecule name

1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.7 2~{H}-pyrazolo[3,4-d]pyrimidin-4-amine

Formula

C5 H5 N5

Formal charge

0

Molecular weight

135.127 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 Nc1ncnc2n[nH]cc12
SMILES OpenEye OEToolkits 2.0.7 c1c2c(ncnc2n[nH]1)N
Canonical SMILES CACTVS 3.385 Nc1ncnc2n[nH]cc12
Canonical SMILES OpenEye OEToolkits 2.0.7 c1c2c(ncnc2n[nH]1)N

IUPAC InChI

InChI=1S/C5H5N5/c6-4-3-1-9-10-5(3)8-2-7-4/h1-2H,(H3,6,7,8,9,10)

IUPAC InChI key

LHCPRYRLDOSKHK-UHFFFAOYSA-N
TVW

wwPDB Information

Atom count

15 (10 without Hydrogen)

Polymer type

Bound ligand

Type description

non-polymer

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2021-01-14

Last modified at

2021-07-02

Status

Released

Obsoleted

Not Assigned