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Compound Detail

CHEMBL1186860

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CC(=O)[C@H]1CNC[C@@H]1NC(=O)[C@@H](N)CCCNC(=N)N[N+](=O)[O-]
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1186860
Phase Preclinical
Structure Type MOL
InChI Key ZKGOLZGTBNUMIM-UTLUCORTSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

329.4
MW (Da)
-2.31
ALogP
7
HBA
6
HBD
175.3
PSA (Ų)
0.09
QED
1
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H23N7O4
MW 329.36
Aromatic Rings 0
Heavy Atoms 23
NP-Likeness 0.41

Data from ChEMBL 36 via Core Engine