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Compound Detail

CHEMBL1186835

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Cc1cc(N)nc(C[C@H]2CNC[C@H]2NC[C@H](C)NCc2ccc(Cl)cc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186835
Phase Preclinical
Structure Type MOL
InChI Key MCSLKWRASMXFKG-RIFZZMRRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

388.0
MW (Da)
2.52
ALogP
5
HBA
4
HBD
75.0
PSA (Ų)
0.56
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H30ClN5
MW 387.96
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness -0.53

Data from ChEMBL 36 via Core Engine