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Compound Detail

CHEMBL4300883

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CC1(c2ccc(Cl)cc2)NC(=O)N(CC(O)CN2CCN(C(c3ccccc3)c3ccccc3)CC2)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4300883
Phase Preclinical
Structure Type MOL
InChI Key VEOHVLUDWOXYPW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

533.1
MW (Da)
3.88
ALogP
5
HBA
2
HBD
76.1
PSA (Ų)
0.43
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H33ClN4O3
MW 533.07
Aromatic Rings 3
Heavy Atoms 38
NP-Likeness -1.20

Data from ChEMBL 36 via Core Engine