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Compound Detail

CHEMBL1194778

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Cc1ccc2cccc(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)/C=C/c4ccc(N5CCCC5=O)cc4)c3Cl)c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1194778
Phase Preclinical
Structure Type MOL
InChI Key BLYCSXNDGLHJTK-GZTJUZNOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

617.5
MW (Da)
6.35
ALogP
5
HBA
1
HBD
91.8
PSA (Ų)
0.22
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C33H30Cl2N4O4
MW 617.53
Aromatic Rings 4
Heavy Atoms 43
NP-Likeness -1.33

Data from ChEMBL 36 via Core Engine