ERGOLINE


SMILES CN1C[C@H](C(=O)N2CCN(c3cccc(=O)n3C)CC2)C[C@@H]2c3cccc4[nH]c(Br)c(c34)C[C@H]21
InChIKey AWFDCTXCTHGORH-HGHGUNKESA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 2
Molecular weight (Da) 523.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
SST2 SSR2 Rat Somatostatin A pKd 4.71 4.71 4.71 ChEMBL
SST1 SSR1 Human Somatostatin A pKd 8.76 8.76 8.76 ChEMBL
SST4 SSR4 Human Somatostatin A pKd 5.31 5.31 5.31 ChEMBL
SST5 SSR5 Human Somatostatin A pKd 4.25 4.25 4.25 ChEMBL
SST2 SSR2 Human Somatostatin A pKd 4.91 4.91 4.91 ChEMBL
SST3 SSR3 Human Somatostatin A pKd 5.53 5.53 5.53 ChEMBL
D4 DRD4 Human Dopamine A pKd 6.91 6.91 6.91 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKd 7.3 7.3 7.3 ChEMBL
D2 DRD2 Human Dopamine A pKd 7.25 7.25 7.25 ChEMBL
SST1 SSR1 Rat Somatostatin A pKd 9.69 9.69 9.69 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database