NOCARDIMICIN B


SMILES CCCCCCCCCCCC(OC(=O)C(CCCCN(O)C(C)=O)NC(=O)c1coc(-c2ccccc2O)n1)C(C)C(=O)NC1CCCCN(O)C1=O
InChIKey QFWVGKDFYOXTQO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 11
Hydrogen bond donors 5
Rotatable bonds 23
Molecular weight (Da) 757.4

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
M5 ACM5 Human Acetylcholine (muscarinic) A pKi 5.93 5.93 5.93 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pKi 6.85 6.85 6.85 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pKi 6.89 6.89 6.89 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pKi 6.2 6.2 6.2 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pKi 6.31 6.31 6.31 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
M5 ACM5 Human Acetylcholine (muscarinic) A pIC50 5.79 5.79 5.79 ChEMBL
M4 ACM4 Human Acetylcholine (muscarinic) A pIC50 5.98 5.98 5.98 ChEMBL
M3 ACM3 Human Acetylcholine (muscarinic) A pIC50 6.2 6.2 6.2 ChEMBL
M2 ACM2 Human Acetylcholine (muscarinic) A pIC50 5.75 5.75 5.75 ChEMBL
M1 ACM1 Human Acetylcholine (muscarinic) A pIC50 5.69 5.69 5.69 ChEMBL