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Compound Detail

CHEMBL5498906

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CN(Cc1ccccc1)C(=O)c1ccc2c(c1)N(Cc1ccc(-c3ccccc3)cc1)C(=O)N(CCCCN)N=C2/C=C/c1ccc(O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5498906
Phase Preclinical
Structure Type MOL
InChI Key FXRZZKZHGIGANW-XIEYBQDHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

663.8
MW (Da)
7.93
ALogP
5
HBA
2
HBD
102.5
PSA (Ų)
0.13
QED
2
Ro5 Violations
12
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C42H41N5O3
MW 663.82
Aromatic Rings 5
Heavy Atoms 50
NP-Likeness -0.70

Data from ChEMBL 36 via Core Engine