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Compound Detail

CHEMBL1190412

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Cc1ccc2cccc(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)/C=C/c4ccc(C(=O)Nc5cccnc5)cc4)c3Cl)c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1190412
Phase Preclinical
Structure Type MOL
InChI Key ICLAQYJFGDWFQD-GZTJUZNOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

654.5
MW (Da)
6.87
ALogP
6
HBA
2
HBD
113.5
PSA (Ų)
0.16
QED
2
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H29Cl2N5O4
MW 654.55
Aromatic Rings 5
Heavy Atoms 46
NP-Likeness -1.41

Data from ChEMBL 36 via Core Engine