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Compound Detail

CHEMBL4595540

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Cc1n[nH]cc1-c1cc2nc(C34CCC(CC3)N4)[nH]c(=O)c2s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595540
Phase Preclinical
Structure Type MOL
InChI Key BCWPQKADGZOWMA-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

327.4
MW (Da)
2.42
ALogP
5
HBA
3
HBD
86.5
PSA (Ų)
0.67
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H17N5OS
MW 327.41
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine