Chembl4794420

Chemical Properties

SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC(=O)[C@H](C)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N[C@@H](CC(C)C)C(=O)O
Hydrogen bond acceptors 20
Hydrogen bond donors 22
Rotatable bonds 48
Molecular weight 1628.9

Drug Properties

Type Small molecule
Endogenous No
Approved No
InChIKey ACFFVPRDWLCNQO-KNQVYGPCSA-N

Database Connections

External Links


Bioactivity

Receptor Experimental Data Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NTS2 NTR2 Human Neurotensin A pKi 8.06 8.06 8.06 ChEMBL
NTS1 NTR1 Human Neurotensin A pKi 8.62 8.62 8.62 ChEMBL