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Compound Detail

CHEMBL1187292

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CN1[C@H]2CC[C@@H]1[C@@H](C#Cc1ccc(N)cc1)[C@@H](c1ccc(Cl)cc1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187292
Phase Preclinical
Structure Type MOL
InChI Key OMDMHRFLCPFHRB-FNAHDJPLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

350.9
MW (Da)
4.54
ALogP
2
HBA
1
HBD
29.3
PSA (Ų)
0.60
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H23ClN2
MW 350.89
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.06

Data from ChEMBL 36 via Core Engine