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Compound Detail

CHEMBL1187993

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N=C(N)NCCC[C@@H]1NC(=O)[C@H]2CC[C@@H](C2)NC(=O)[C@H](CC(=O)O)NC(=O)CNC1=O

Basic Information

ChEMBL ID CHEMBL1187993
Phase Preclinical
Structure Type MOL
InChI Key SLTMEZLQPRTTBL-BJDJZHNGSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

439.5
MW (Da)
-2.89
ALogP
6
HBA
8
HBD
215.6
PSA (Ų)
0.12
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H29N7O6
MW 439.47
Aromatic Rings 0
Heavy Atoms 31
NP-Likeness 1.04

Data from ChEMBL 36 via Core Engine