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HVB : Summary

Code

HVB

One-letter code

X

Molecule name

1-azanylpropylideneazanium

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.6 1-azanylpropylideneazanium

Formula

C3 H9 N2

Formal charge

1

Molecular weight

73.117 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 CCC(N)=[NH2+]
SMILES OpenEye OEToolkits 2.0.6 CCC(=[NH2+])N
Canonical SMILES CACTVS 3.385 CCC(N)=[NH2+]
Canonical SMILES OpenEye OEToolkits 2.0.6 CCC(=[NH2+])N

IUPAC InChI

InChI=1S/C3H8N2/c1-2-3(4)5/h2H2,1H3,(H3,4,5)/p+1

IUPAC InChI key

GNFWGDKKNWGGJY-UHFFFAOYSA-O
HVB

wwPDB Information

Atom count

14 (5 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2018-12-19

Last modified at

2019-06-21

Status

Released

Obsoleted

Not Assigned