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Compound Detail

CHEMBL5499036

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COc1cccc2c1Sc1ccccc1C=C2OP(=O)(O)O[C@H]1C[C@@H](C)CC[C@@H]1C(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5499036
Phase Preclinical
Structure Type MOL
InChI Key DNBJHNLGGDWRLP-KPLVRAHFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

474.6
MW (Da)
7.25
ALogP
5
HBA
1
HBD
65.0
PSA (Ų)
0.44
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H31O5PS
MW 474.56
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness 0.54

Data from ChEMBL 36 via Core Engine