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Compound Detail

CHEMBL5499508

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NCCCCN1N=C(CCc2ccc(O)cc2)c2ccc(C(=O)NCCCc3ccccc3)cc2N(Cc2ccc(-c3ccccc3)cc2)C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499508
Phase Preclinical
Structure Type MOL
InChI Key NQXWBGCQXOZFOQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

679.9
MW (Da)
7.94
ALogP
5
HBA
3
HBD
111.3
PSA (Ų)
0.10
QED
2
Ro5 Violations
15
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C43H45N5O3
MW 679.87
Aromatic Rings 5
Heavy Atoms 51
NP-Likeness -0.52

Data from ChEMBL 36 via Core Engine