DACARBAZINE

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Trade Names
Synonyms
DIC
Status
Molecule Category Free-form
ATC L01AX04
UNII 7GR28W0FJI

Structure

InChI Key FDKXTQMXEQVLRF-ZHACJKMWSA-N
Smiles CN(C)/N=N/c1[nH]cnc1C(N)=O
InChI
InChI=1S/C6H10N6O/c1-12(2)11-10-6-4(5(7)13)8-3-9-6/h3H,1-2H3,(H2,7,13)(H,8,9)/b11-10+

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H10N6O
Molecular Weight 182.19
AlogP 0.07
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 99.73
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 13.0

Pharmacology

Mechanism of Action Action Reference
DNA inhibitor INHIBITOR DailyMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 90.13-97.65
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 90.13-97.65

Cross References

Resources Reference
ChEMBL CHEMBL476
DrugBank DB00851
DrugCentral 773
FDA SRS 7GR28W0FJI
Guide to Pharmacology 9075
KEGG C06936
PubChem 135398738
SureChEMBL SCHEMBL5560
ZINC ZINC000100019007
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