Somatostatin-14


SMILES C[C@@H](C(=O)NCC(=O)N[C@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC1=O)CCCCN)CC(=O)N)CC2=CC=CC=C2)CC3=CC=CC=C3)CC4=CNC5=CC=CC=C54)CCCCN)C(C)O)CC6=CC=CC=C6)C(C)O)CO)C(=O)O)N
InChIKey NHXLMOGPVYXJNR-UYURUMNQSA-N

Chemical properties

Hydrogen bond acceptors 23
Hydrogen bond donors 22
Rotatable bonds 26
Molecular weight (Da) 1636.7

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
SST5 SSR5 Human Somatostatin A pKi 8.63 9.37 9.92 PDSP Ki database
SST1 SSR1 Human Somatostatin A pKi 8.65 9.19 10.0 PDSP Ki database
SST3 SSR3 Human Somatostatin A pKi 8.68 9.4 10.0 PDSP Ki database
SST4 SSR4 Human Somatostatin A pKi 8.39 8.91 9.7 PDSP Ki database
SST2 SSR2 Human Somatostatin A pKi 8.89 10.0 10.52 PDSP Ki database
SST3 SSR3 Mouse Somatostatin A pKi 9.11 9.79 10.15 PDSP Ki database
SST2 SSR2 Mouse Somatostatin A pKi 8.84 9.54 10.1 PDSP Ki database
SST4 SSR4 Rat Somatostatin A pKi 8.18 8.73 9.07 PDSP Ki database
SST2 SSR2 Rat Somatostatin A pKi 8.19 9.47 10.39 PDSP Ki database
SST3 SSR3 Rat Somatostatin A pKi 8.42 9.36 10.15 PDSP Ki database
SST4 SSR4 Mouse Somatostatin A pKi 8.92 8.92 8.92 PDSP Ki database
SST1 SSR1 Rat Somatostatin A pKi 8.35 9.35 10.0 PDSP Ki database
SST1 SSR1 Human Somatostatin A pKi 8.02 8.02 8.02 Drug Central
SST2 SSR2 Human Somatostatin A pKi 7.98 7.98 7.98 Drug Central
SST3 SSR3 Human Somatostatin A pKi 8.0 8.0 8.0 Drug Central
SST4 SSR4 Human Somatostatin A pKi 8.03 8.03 8.03 Drug Central
SST5 SSR5 Human Somatostatin A pKi 8.01 8.01 8.01 Drug Central
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
δ OPRD Rat Opioid A pIC50 8.24 8.24 8.24 Drug Central
SST3 SSR3 Mouse Somatostatin A pIC50 8.0 8.0 8.0 Drug Central
SST2 SSR2 Mouse Somatostatin A pIC50 8.02 8.02 8.02 Drug Central
μ OPRM Rat Opioid A pIC50 8.09 8.09 8.09 Drug Central