Structure

InChI Key OFZJKCQENFPZBH-UHFFFAOYSA-N
Smile O=C(Nc1nc(-c2cc(Cl)cs2)c(N2CCN(C3CCCCC3)CC2)s1)c1cnc(N2CCC(C(=O)O)CC2)c(Cl)c1
InChI
InChI=1S/C29H34Cl2N6O3S2/c30-20-15-23(41-17-20)24-27(37-12-10-35(11-13-37)21-4-2-1-3-5-21)42-29(33-24)34-26(38)19-14-22(31)25(32-16-19)36-8-6-18(7-9-36)28(39)40/h14-18,21H,1-13H2,(H,39,40)(H,33,34,38)

Physicochemical Descriptors

Property Name Value
Molecular Formula C29H34Cl2N6O3S2
Molecular Weight 649.67
AlogP 6.58
Hydrogen Bond Acceptor 9.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 7.0
Polar Surface Area 101.9
Molecular species ACID
Aromatic Rings 3.0
Heavy Atoms 42.0

Pharmacology

Action Mechanism of Action Reference
AGONIST Thrombopoietin receptor agonist PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Liver Diseases 3 D008107 ClinicalTrials
Purpura, Thrombocytopenic, Idiopathic 3 D016553 ClinicalTrials
Thrombocytopenia 3 D013921 ClinicalTrials
Blood Platelet Disorders 2 D001791 ClinicalTrials
Anemia, Aplastic 2 D000741 ClinicalTrials

Related Entries

MCS

Scaffolds

Cross References

Resources Reference
CAS NUMBER 570406-98-3
ChEMBL CHEMBL2103883
DrugBank DB11995
DrugCentral 5285
EPA CompTox DTXSID30205667
FDA SRS 3H8GSZ4SQL
Guide to Pharmacology 9953
PubChem 9852519
SureChEMBL SCHEMBL289354
ZINC ZINC000072190218