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Compound Detail

CHEMBL1208003

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O=P(O)(O)C(CCCc1cccc(Nc2ccccc2)c1)S(=O)(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1208003
Phase Preclinical
Structure Type MOL
InChI Key CSBMAVBLBVKTJH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

385.4
MW (Da)
3.14
ALogP
4
HBA
4
HBD
123.9
PSA (Ų)
0.41
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H20NO6PS
MW 385.38
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.16

Data from ChEMBL 36 via Core Engine