CP-12
1-[3-[(3S,6S,12S,15S,18S,21S,24S,27S,30S,33S,36S,39S,42S,45S)-3,30-bis(4-aminobutyl)-24,36-bis[(2S)-butan-2-yl]-12-(3-carbamimidamidopropyl)-33,42-bis(hydroxymethyl)-27-[(4-hydroxyphenyl)methyl]-39-(1H-imidazol-4-ylmethyl)-15-(1H-indol-3-ylmethyl)-21-(2-methylpropyl)-2,5,11,14,17,20,23,26,29,32,35,38,41,44-tetradecaoxo-1,4,10,13,16,19,22,25,28,31,34,37,40,43-tetradecazatricyclo[43.3.0.06,10]octatetracontan-18-yl]propyl]guanidine
Molecular Identity
CP-12
1-[3-[(3S,6S,12S,15S,18S,21S,24S,27S,30S,33S,36S,39S,42S,45S)-3,30-bis(4-aminobutyl)-24,36-bis[(2S)-butan-2-yl]-12-(3-carbamimidamidopropyl)-33,42-bis(hydroxymethyl)-27-[(4-hydroxyphenyl)methyl]-39-(1H-imidazol-4-ylmethyl)-15-(1H-indol-3-ylmethyl)-21-(2-methylpropyl)-2,5,11,14,17,20,23,26,29,32,35,38,41,44-tetradecaoxo-1,4,10,13,16,19,22,25,28,31,34,37,40,43-tetradecazatricyclo[43.3.0.06,10]octatetracontan-18-yl]propyl]guanidine
PubChem CID: 135390812
2D Structure
Properties
C84H131N25O17
Molecular Formula
1763.10
Molecular Weight
g/mol
1762.0155
Exact Mass
Da
0.6
XLogP
Drug-like (Lipinski: < 5)
671
TPSA
May have limited oral absorption
25
H-Bond Donors
22
H-Bond Acceptors
3640
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(4)
CP-12SM5MFZ7FKPCP12PROLYL-L-SERYL-L-HISTIDYL-L-ISOLEUCYL-L-SERYL-L-LYSYL-L-TYROSYL-L-ISOLEUCYL-L-LEUCYL- L-ARGINYL-L-TRYPTOPHANYL-L-ARGINYL-L-PROLYL-L-LYSYL), CYCLO (1-14)
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to CP-12
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