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Compound Detail

CHEMBL4787870

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CCO[C@H](C[C@H](C(C)C)N(C)C(=O)[C@@H](NC(=O)C1CN(C)CCN1C)[C@@H](C)CC)c1nc(C(=O)N[C@@H](Cc2ccccc2)C[C@H](C)C(=O)O)cs1

Basic Information

ChEMBL ID CHEMBL4787870
Phase Preclinical
Structure Type MOL
InChI Key CVWLBRCBRNYPLA-UAZAYMOQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

729.0
MW (Da)
4.32
ALogP
9
HBA
3
HBD
144.4
PSA (Ų)
0.19
QED
1
Ro5 Violations
19
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C38H60N6O6S
MW 729.00
Aromatic Rings 2
Heavy Atoms 51
NP-Likeness -0.15

Literature References

Data from ChEMBL 36 via Core Engine