Hydralazine hydrochloride

CAS Number: 304-20-1
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NNc1nncc2ccccc12.Cl
Molecule Information
Mutagenic: high Tumorigenic: high Irritant: none
Formula
HCl.C8H8N4
Molecular Weight
160.18
Drug-likeness
-4.3224
CAS
304-20-1
InChI key
ZUXNZUWOTSUBMN-UHFFFAOYSA-N
SMILES
NNc1nncc2ccccc12.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
high
Tumorigenic
high
Handling Watch
Irritant: none | Reproductive effective: high
PropertyValue
CAS Number 304-20-1
Molecule Name Hydralazine hydrochloride
Molecular Formula HCl.C8H8N4
SMILES NNc1nncc2ccccc12.Cl
InChI InChI=1S/C8H8N4.ClH/c9-11-8-7-4-2-1-3-6(7)5-10-12-8;/h1-5H,9H2,(H,11,12);1H
InChI Key ZUXNZUWOTSUBMN-UHFFFAOYSA-N
CanonicalSyTyLFy 5b4511929cdc2829
TotalMolweight 196.64
Molecular Weight 160.18
MonoisotopicMass 160.074896
CLogP 1.3381
CLogS -2.295
H Acceptors 4
H Donors 2
TotalSurfaceArea 125.36
Relative PSA 0.38824
PolarSurfaceArea 63.83
Drug-likeness -4.3224
Mutagenic high
Tumorigenic high
Reproductive Effective high
Irritant none
Nasty Functions hydrazine
Shape Index 0.58333
Molecula Flexibility 0.089477
Molecular Complexity 0.68239
Fragments 2
Non HAtoms 12
NonCHAtoms 4
Electronegative Atoms 4
Rotatable Bond 1
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 10
Sp3Atoms 1
Aromatic Nitrogens 2

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