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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 85556   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Angiotensin-converting enzyme 2


(BOVINE)
BDBM85556
PNG
(Ang(1-7))
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@@H](NC(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(O)=O |wU:47.47,8.17,20.21,wD:4.4,24.32,35.36,60.63,2.2,(13.52,3.66,;12.19,2.89,;12.19,1.35,;13.52,.58,;10.85,.58,;10.85,-.96,;12.19,-1.73,;13.52,-.96,;12.19,-3.27,;10.85,-4.04,;10.85,-5.58,;9.52,-6.35,;9.52,-7.89,;10.85,-8.66,;10.85,-10.2,;12.19,-7.89,;12.19,-6.35,;13.52,-4.04,;14.85,-3.27,;14.85,-1.73,;16.19,-4.04,;17.52,-3.27,;18.85,-4.04,;18.85,-5.58,;20.19,-3.27,;20.19,-1.73,;21.52,-.96,;21.52,.58,;22.86,1.35,;22.86,2.89,;24.19,3.66,;21.52,3.66,;21.52,-4.04,;22.86,-3.27,;22.86,-1.73,;24.19,-4.04,;24.19,-5.58,;25.52,-3.27,;26.86,-4.04,;28.19,-3.27,;26.86,-5.58,;16.19,-5.58,;17.52,-6.35,;14.85,-6.35,;9.52,1.35,;8.18,.58,;9.52,2.89,;8.18,3.66,;6.85,2.89,;5.52,3.66,;5.36,5.19,;3.85,5.51,;3.08,4.18,;4.11,3.03,;8.18,5.2,;6.85,5.97,;9.52,5.97,;10.93,5.34,;11.96,6.49,;11.19,7.82,;9.68,7.5,;8.53,8.53,;8.86,10.04,;7.07,8.06,)|
Show InChI InChI=1S/C41H62N12O11/c1-5-22(4)33(38(61)50-29(17-24-19-45-20-47-24)39(62)53-15-7-9-30(53)40(63)64)52-36(59)28(16-23-10-12-25(54)13-11-23)49-37(60)32(21(2)3)51-35(58)27(8-6-14-46-41(43)44)48-34(57)26(42)18-31(55)56/h10-13,19-22,26-30,32-33,54H,5-9,14-18,42H2,1-4H3,(H,45,47)(H,48,57)(H,49,60)(H,50,61)(H,51,58)(H,52,59)(H,55,56)(H,63,64)(H4,43,44,46)/t22-,26-,27-,28-,29-,30-,32-,33-/m0/s1
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PC cid
PC sid
UniChem

Similars

PubMed
1.00E+3n/an/an/an/an/an/an/an/a



Washington State University

Curated by PDSP Ki Database




J Pharmacol Exp Ther 291: 1242-9 (1999)


BindingDB Entry DOI: 10.7270/Q2377783
More data for this
Ligand-Target Pair