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Compound Detail

CHEMBL40178

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CN(C)[C@H]1CC[C@@H](c2ccc(Cl)cc2)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL40178
Phase Preclinical
Structure Type MOL
InChI Key VBGHDLDPLPNLTB-YJBOKZPZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

285.8
MW (Da)
4.87
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.76
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H20ClN
MW 285.82
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.02

Data from ChEMBL 36 via Core Engine