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Compound Detail

CHEMBL534520

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N=C(NC1CCCCC1)c1ccc(N2CCN(c3ccc(C(=N)NC4CCCCC4)cc3)CC2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL534520
Phase Preclinical
Structure Type MOL
InChI Key JYIPIRKUSSJPNB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

486.7
MW (Da)
5.51
ALogP
4
HBA
4
HBD
78.2
PSA (Ų)
0.32
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H42N6
MW 486.71
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness -0.49

Data from ChEMBL 36 via Core Engine