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Compound Detail

CHEMBL2135201

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O=C(c1ccoc1)N1CCN(c2cc(-c3ccco3)nc3cc(-c4cccc(-c5ccco5)c4)nn23)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2135201
Phase Preclinical
Structure Type MOL
InChI Key LOZODBLFZYDRLO-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

505.5
MW (Da)
5.47
ALogP
8
HBA
0
HBD
93.2
PSA (Ų)
0.31
QED
2
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H23N5O4
MW 505.53
Aromatic Rings 6
Heavy Atoms 38
NP-Likeness -1.51

Activity Summary

EC50 2 meas.

Data from ChEMBL 36 via Core Engine