TRILACICLIB DIHYDROCHLORIDE

Search structure
Synonyms:
Status: Approved (2021)
Entry Type: Small molecule
Molecule Category: UKNOWN
UNII: 4BX07W725T

Structure
InChI Key BRCYOXKEDFAUSA-UHFFFAOYSA-N
Smile CN1CCN(c2ccc(Nc3ncc4cc5n(c4n3)C3(CCCCC3)CNC5=O)nc2)CC1.Cl.Cl
InChI
InChI=1S/C24H30N8O.2ClH/c1-30-9-11-31(12-10-30)18-5-6-20(25-15-18)28-23-26-14-17-13-19-22(33)27-16-24(7-3-2-4-8-24)32(19)21(17)29-23;;/h5-6,13-15H,2-4,7-12,16H2,1H3,(H,27,33)(H,25,26,28,29);2*1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H32Cl2N8O
Molecular Weight 519.48
AlogP 2.72
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 3.0
Polar Surface Area 91.21
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 33.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR Cyclin-dependent kinase 4 inhibitor PubMed FDA PubMed

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Small Cell Lung Carcinoma 4 D055752 FDA

Cross References

Resources Reference
ChEMBL CHEMBL4650272
FDA SRS 4BX07W725T
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