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Compound Detail

CHEMBL3787789

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O=C(N[C@H]1CN2CCC1CC2)c1cc(C(=O)c2ccccc2)n2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3787789
Phase Preclinical
Structure Type MOL
InChI Key LVMUURADDQKMMM-IBGZPJMESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

373.5
MW (Da)
2.99
ALogP
4
HBA
1
HBD
53.8
PSA (Ų)
0.72
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 C23H23N3O2
MW 373.46
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -0.74

Data from ChEMBL 36 via Core Engine