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Compound Detail

CHEMBL5028936

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CC(=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCNC(=N)N)N[C@@H](CCCN)C(=O)NCCN1CCN(CCCCC2CCN(CC(=O)N3c4ccccc4NC(=O)c4ccccc43)CC2)CC1

Basic Information

ChEMBL ID CHEMBL5028936
Phase Preclinical
Structure Type MOL
InChI Key DTQIXKQBUYCCQM-FSEITFBQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

931.2
MW (Da)
-0.51
ALogP
13
HBA
10
HBD
306.5
PSA (Ų)
0.04
QED
3
Ro5 Violations
24
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C46H70N14O7
MW 931.16
Aromatic Rings 2
Heavy Atoms 67
NP-Likeness -0.29

Data from ChEMBL 36 via Core Engine