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Compound Detail

CHEMBL1904819

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CN(C)CCN=C(S)Nc1ccccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1904819
Phase Preclinical
Structure Type MOL
InChI Key OFBFNFQGVFVHQX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

257.8
MW (Da)
2.60
ALogP
2
HBA
2
HBD
27.6
PSA (Ų)
0.49
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H16ClN3S
MW 257.79
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -1.72

Data from ChEMBL 36 via Core Engine