General
Preferred name
Methylnitronitrosoguanidine
Synonyms
MNNG ()
1-Methyl-3-nitro-1-nitrosoguanidine ()
N-Methyl-N-nitroso-N¡ä-nitroguanidine, Methylnitronitrosoguanidine, MNNG, MNG ()
P&D ID
PD121821
CAS
70-25-7
100234-53-5
Tags
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
1
Organisms
0
Compound Sets
4
AdooQ Bioactive Compound Library
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
28
Properties
(calculated by RDKit )
Molecular Weight
147.04
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
2
Rotatable Bonds
2
Ring Count
0
Aromatic Ring Count
0
cLogP
-0.68
TPSA
111.69
Fraction CSP3
0.5
Chiral centers
0.0
Largest ring
0.0
QED
0.18
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
DNA Damage/DNA Repair
Cell Cycle/DNA Damage
Target
DNA alkylator
DNA alkylator/crosslinker
Source data
