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Compound Detail

CHEMBL6068889

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Nc1nc(/C(=N/OC(C(=O)O)C2CCC(F)(F)CC2)C(=O)N[C@@H]2C(=O)N3C(C(=O)O)=C(CSCCNC(=O)c4ccc(O)c(O)c4Cl)CS[C@H]23)cs1

Basic Information

ChEMBL ID CHEMBL6068889
Phase Preclinical
Structure Type MOL
InChI Key MYVYPWYPWLSQLQ-MFALSVABSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

805.3
MW (Da)
2.69
ALogP
14
HBA
7
HBD
254.1
PSA (Ų)
0.05
QED
3
Ro5 Violations
14
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H31ClF2N6O10S3
MW 805.26
Aromatic Rings 2
Heavy Atoms 52
NP-Likeness -0.28

Data from ChEMBL 36 via Core Engine