RO320-2947/001


SMILES COc1cc(NC(=O)N[C@H](C(O)C)CN2CCC(CC2)Cc2ccc(cc2)Cl)cc(c1OC)OC
InChIKey JYDVJNOBDUOZJC-UGNFMNBCSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 10
Molecular weight (Da) 505.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK1 NK1R Human Tachykinin A pKi 9.4 9.4 9.4 Guide to Pharmacology
NK1 NK1R Human Tachykinin A pKi 8.0 8.0 8.0 Drug Central
NK1 NK1R Human Tachykinin A pKi 9.48 9.69 9.9 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database