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Compound Detail

CHEMBL1436264

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O=C1C=C(c2ccc3ncccc3c2)C[C@@H](c2ccc(Cl)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1436264
Phase Preclinical
Structure Type MOL
InChI Key FCJYAOAHBBNEIY-QGZVFWFLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

333.8
MW (Da)
5.42
ALogP
2
HBA
0
HBD
30.0
PSA (Ų)
0.63
QED
1
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H16ClNO
MW 333.82
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.38

Data from ChEMBL 36 via Core Engine