kassinin [4440]



kassinin


SMILES CSCCC(NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(NC(=O)C(Cc1ccccc1)NC(=O)C(CCC(N)=O)NC(=O)C(CC(=O)O)NC(=O)C(CO)NC(=O)C(CCCCN)NC(=O)C1CCCN1C(=O)C(NC(=O)C(N)CC(=O)O)C(C)C)C(C)C)C(N)=O
InChIKey NXTPETCPVNEEOP-UHFFFAOYSA-N
Sequence DVPKSDQFVGLM
HELM PEPTIDE1{(D,[dD]).(V,[dV]).(P,[dP]).(K,[dK]).(S,[dS]).(D,[dD]).(Q,[dQ]).(F,[dF]).(V,[dV]).G.(L,[dL]).(M,[dM]).[am]}$$$$V2.0

Chemical Properties

Hydrogen bond acceptors 19
Hydrogen bond donors 17
Rotatable bonds 43
Log P -5.040
Molecular weight (Da) 1333.7
Stereochemistry info unspecified

Database connections

Model (AF2) NK3 NK1

Bioactivities

Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database
Receptor Activity Source
Protein Gene Species Family Class Type Min Avg Max Database

kassinin


Drug properties

Molecular type Peptide
Physiological/Surrogate Surrogate
Approved drug No

Distribution across phases (no. indications)

Phase I 0
Phase II 0
Phase III 0
Phase IV 0

Database connections

Model (AF2) NK3 NK1

Compound is not listed as a drug.