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Compound Detail

CHEMBL589023

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

Basic Information

ChEMBL ID CHEMBL589023
Phase Preclinical
Structure Type MOL
InChI Key JUKZZXZIVGSBKH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

490.7
MW (Da)
6.00
ALogP
4
HBA
4
HBD
78.2
PSA (Ų)
0.15
QED
1
Ro5 Violations
14
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H46N6
MW 490.74
Aromatic Rings 2
Heavy Atoms 36
NP-Likeness -0.42

Data from ChEMBL 36 via Core Engine