SALCAPROZIC ACID

Search structure


Synonyms:	Salcaprozic acid
Status:	Phase 1
Entry Type:	Small molecule
Molecule Category:	UNKNOWN
UNII:	X88E147FCU

Structure


InChI Key	NJEKDCUDSORUJA-UHFFFAOYSA-N
Smile	O=C(O)CCCCCCCNC(=O)c1ccccc1O
InChI	InChI=1S/C15H21NO4/c17-13-9-6-5-8-12(13)15(20)16-11-7-3-1-2-4-10-14(18)19/h5-6,8-9,17H,1-4,7,10-11H2,(H,16,20)(H,18,19)

Physicochemical Descriptors

Property Name	Value
Molecular Formula	C15H21NO4
Molecular Weight	279.34
AlogP	2.55
Hydrogen Bond Acceptor	3.0
Hydrogen Bond Donor	3.0
Number of Rotational Bond	9.0
Polar Surface Area	86.63
Molecular species	ACID
Aromatic Rings	1.0
Heavy Atoms	20.0

Cross References

Resources	Reference
ChEMBL	CHEMBL16503
EPA CompTox	DTXSID60171523
FDA SRS	X88E147FCU
PubChem	158789
SureChEMBL	SCHEMBL4586235
ZINC	ZINC000001893718

CONTENTS