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Compound Detail

CHEMBL1205333

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CC(OP(=O)(O)O)[C@H](NC(=O)COc1cccc2ccccc12)C(=O)N[C@@H](CC1CCCCC1)[C@H](O)[C@@H](O)[C@@H](C(=O)N[C@H]1C(O)=Cc2ccccc21)C(C)C

Basic Information

ChEMBL ID CHEMBL1205333
Phase Preclinical
Structure Type MOL
InChI Key WPMCAFGGHDSURD-LCHGPDHOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

781.8
MW (Da)
4.42
ALogP
9
HBA
8
HBD
224.0
PSA (Ų)
0.09
QED
2
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C40H52N3O11P
MW 781.84
Aromatic Rings 3
Heavy Atoms 55
NP-Likeness 0.20

Data from ChEMBL 36 via Core Engine