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Compound Detail

CHEMBL5315914

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Cc1cnc(Nc2ccc(C(=O)N3CCNCC3)cn2)nc1-c1ccc2scnc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5315914
Phase Preclinical
Structure Type MOL
InChI Key MYSLRACEMAVVLZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

431.5
MW (Da)
3.25
ALogP
8
HBA
2
HBD
95.9
PSA (Ų)
0.51
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H21N7OS
MW 431.53
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -1.77

Data from ChEMBL 36 via Core Engine