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Compound Detail

CHEMBL6070160

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CC1(N)CCN(c2cnc(Sc3cccc(NC(=O)c4nccs4)c3Cl)cn2)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL6070160
Phase Preclinical
Structure Type MOL
InChI Key YISNUWKZNLSZKX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

461.0
MW (Da)
4.31
ALogP
8
HBA
2
HBD
97.0
PSA (Ų)
0.59
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H21ClN6OS2
MW 461.02
Aromatic Rings 3
Heavy Atoms 30
NP-Likeness -1.59

Data from ChEMBL 36 via Core Engine