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Compound Detail

CHEMBL5499115

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C[C@H](c1cccc(-c2ncc(OCC3CCN(C)CC3)cn2)c1)n1nc(-c2cccc(C#N)c2)ccc1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499115
Phase Preclinical
Structure Type MOL
InChI Key UIXLPSRJOFRUNA-OAQYLSRUSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

506.6
MW (Da)
4.57
ALogP
8
HBA
0
HBD
96.9
PSA (Ų)
0.36
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H30N6O2
MW 506.61
Aromatic Rings 4
Heavy Atoms 38
NP-Likeness -1.45

Data from ChEMBL 36 via Core Engine