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Compound Detail

CHEMBL5315282

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CNC(=O)c1nnc(NC(=O)C2CC2)cc1Nc1cccc(C(=O)Nc2ccc(-c3ncn(C)n3)cc2)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5315282
Phase Preclinical
Structure Type MOL
InChI Key IFNGVEQYOCEYBH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

541.6
MW (Da)
2.98
ALogP
10
HBA
4
HBD
165.1
PSA (Ų)
0.25
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H27N9O4
MW 541.57
Aromatic Rings 4
Heavy Atoms 40
NP-Likeness -1.46

Data from ChEMBL 36 via Core Engine