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Compound Detail

CHEMBL5222082

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CC(C)(Oc1cccc(N2CCC[C@@H](C(=O)N(Cc3ccc(-c4c[nH]c5ncccc45)cc3)C3CC3)C2)c1)C(=O)N1CCNCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5222082
Phase Preclinical
Structure Type MOL
InChI Key IVPHMOVVMKAGJK-MUUNZHRXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

620.8
MW (Da)
5.23
ALogP
6
HBA
2
HBD
93.8
PSA (Ų)
0.27
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C37H44N6O3
MW 620.80
Aromatic Rings 4
Heavy Atoms 46
NP-Likeness -1.45

Data from ChEMBL 36 via Core Engine