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Compound Detail

CHEMBL1206837

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CC[C@H](C)[C@H](NC(=O)[C@@H](C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](COP(=O)(O)O)NC(=O)COc1cccc2ccccc12)C(C)C)C(=O)N(C)c1ccccn1

Basic Information

ChEMBL ID CHEMBL1206837
Phase Preclinical
Structure Type MOL
InChI Key DYINIOSMQYMKFF-MDZZQZJRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

825.9
MW (Da)
4.88
ALogP
9
HBA
6
HBD
216.7
PSA (Ų)
0.08
QED
2
Ro5 Violations
21
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C42H60N5O10P
MW 825.94
Aromatic Rings 3
Heavy Atoms 58
NP-Likeness -0.05

Data from ChEMBL 36 via Core Engine