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Compound Detail

CHEMBL1184703

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CCCCN(CC)c1cc(C)nc2c1NC(=O)CN2c1ccc(C(C)C)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1184703
Phase Preclinical
Structure Type MOL
InChI Key AMYOUBCJPDSVMX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

415.0
MW (Da)
5.88
ALogP
4
HBA
1
HBD
48.5
PSA (Ų)
0.61
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H31ClN4O
MW 414.98
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -1.18

Data from ChEMBL 36 via Core Engine