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Compound Detail

CHEMBL1199237

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Nc1nc(-n2cc(-c3ccncc3)nn2)nc2c1ncn2[C@@H]1O[C@H](COS(=O)(=O)NC(=O)c2ccccc2O)[C@@H](O)[C@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1199237
Phase Preclinical
Structure Type MOL
InChI Key GJMNRVCKMHYSIG-DYVMYPEFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

610.6
MW (Da)
-0.93
ALogP
17
HBA
5
HBD
255.6
PSA (Ų)
0.14
QED
2
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H22N10O8S
MW 610.57
Aromatic Rings 5
Heavy Atoms 43
NP-Likeness -0.32

Data from ChEMBL 36 via Core Engine