ORM-13070

Search structure


Status:	Phase 1
Entry Type:	Small molecule
Molecule Category:	UNKNOWN
UNII:	X676C040B7

Structure


InChI Key	VGIYMYGMVXPMKV-KRWDZBQOSA-N
Smile	COCc1cccnc1N1CCN(C[C@H]2COc3ccccc3O2)CC1
InChI	InChI=1S/C20H25N3O3/c1-24-14-16-5-4-8-21-20(16)23-11-9-22(10-12-23)13-17-15-25-18-6-2-3-7-19(18)26-17/h2-8,17H,9-15H2,1H3/t17-/m0/s1

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C20H25N3O3
Molecular Weight	355.44
AlogP	2.19
Hydrogen Bond Acceptor	6.0
Hydrogen Bond Donor	0.0
Number of Rotational Bond	5.0
Polar Surface Area	47.06
Molecular species	NEUTRAL
Aromatic Rings	2.0
Heavy Atoms	26.0

Cross References

Resources	Reference
ChEMBL	CHEMBL4302506
FDA SRS	X676C040B7
PubChem	46209194
SureChEMBL	SCHEMBL2458615

CONTENTS