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Compound Detail

CHEMBL1187713

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CCOC(=O)N1CCN(C(=O)CC[C@H](N)C(=O)N2CCC[C@H]2C#N)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1187713
Phase Preclinical
Structure Type MOL
InChI Key VJCZYAVLLJEXEB-KBPBESRZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

365.4
MW (Da)
-0.09
ALogP
6
HBA
1
HBD
120.0
PSA (Ų)
0.73
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H27N5O4
MW 365.43
Aromatic Rings 0
Heavy Atoms 26
NP-Likeness -0.71

Data from ChEMBL 36 via Core Engine