Name: PCS1055 dihydrochloride
Rating: 5 (10 reviews)

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HIT ID:HIT212672795
Cas No:361979-40-0
常用名:PCS1055 dihydrochloride
IUPAC:N-[2-(1-benzylpiperidin-4-yl)ethyl]-3,4-diazatricyclo[9.4.0.0^{2,7}]pentadeca-1(15),2,4,6,11,13-hexaen-5-amine dihydrochloride
IUPAC:N-[2-(1-benzylpiperidin-4-yl)ethyl]-3,4-diazatricyclo[9.4.0.0^{2,7}]pentadeca-1(15),2,4,6,11,13-hexaen-5-amine dihydrochloride
InChI key:VSCSFYDNGYAWKG-UHFFFAOYSA-N

分子式:C27H34Cl2N4
分子量:485.5
氢键供体数 (HBD):1
氢键受体数 (HBA):4
LogP:5.462295
SMILES:Cl.Cl.C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2CCCc3ccccc3-c2nn1
SMILES:Cl.Cl.C(CC1CCN(Cc2ccccc2)CC1)Nc1cc2CCCc3ccccc3-c2nn1

PCS1055 dihydrochloride is an effective, selective, and competitive muscarinic M4 receptor antagonist (IC50: 18.1 nM and a Kd: 5.72 nM). PCS1055 dihydrochloride is also a potent AChE inhibitor (IC50 s: 22 nM and 120 nM for electric eel and human AChE, respectively). PCS1055 dihydrochloride inhibits radioligand [3H]-NMS binding to the M4 receptor (Ki: 6.5 nM). PCS1055 dihydrochloride shows >100-fold selectivity over M1-, M3-, and M5-receptors and 30-fold selectivity at the M2 receptor.

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