 |
| Ligand Name: Ixazomib |
| Ligand Type: non-polymer |
| Ligand ID: COVPDB329 |
PubChem:
25183872
|
Synonym(s):
- 1072833-77-2
- mln2238
- mln-2238
- mln 2238
- (r)-1-(2-(2,5-dichlorobenzamido)acetamido)-3-methylbutylboronic acid
- (r)-(1-(2-(2,5-dichlorobenzamido)acetamido)-3-methylbutyl)boronic acid
- unii-71050168a2
- chembl2141296
- [(1r)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]boronic acid
- 71050168a2
- ixazomib [inn]
- ixazomib [usan:inn]
- ixazomib (mln2238)
- ixozamib
- ixazomib impurity
- ixazomib (usan)
- ixazomib(mln2238)
- mln2238(ixazomib)
- ixazomib (mln-2238)
- cc-437
- c14h19bcl2n2o4
- gtpl8450
- mln-9708 free base
- schembl3742758
- chebi:90942
- ex-a547
- amy19380
- bcp02410
- bcp24078
- abp000732
- bdbm50398609
- mfcd18251438
- nsc766907
- s2180
- akos015995120
- zinc169946773
- bcp9000953
- ccg-264938
- cs-1657
- db09570
- nsc-766907
- sb19501
- boronic acid, b-((1r)-1-((2-((2,5-dichlorobenzoyl)amino)acetyl)amino)-3-methylbutyl)-
- 1072833-77-2 (free)
- ncgc00249611-01
- ncgc00249611-03
- ncgc00249611-04
- ac-28456
- as-55976
- at-42310
- hy-10453
- ab0033791
- sw219743-1
- x7547
- j3.602.191h
- d10130
- mln2238,mln 2238,mln-2238/
- s-7673
- j-001749
- brd-k78659596-001-01-3
- q20948663
- 1-(2-(2,5-dichlorobenzamido)acetamido)-3-methylbutylboronic acid
- n-[(1r)-1-borono-3-methylbutyl]-n(2)-(2,5-dichlorobenzoyl)glycinamide
- [(1r)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methyl-butyl]boronic acid
- [(1r)-1-{2-[(2,5-dichlorophenyl)formamido]acetamido}-3-methylbutyl]boronic acid
- mln-2238|||[(1r)-1-[[2-[(2,5-dichlorobenzoyl)amino]acetyl]amino]-3-methylbutyl]boronic acid
show 65 synonym(s)
|
| DrugBank: DB09570 |
ChEMBL: CHEMBL2141296 |
| Canonical SMILES: CC(C)C[C@@H](B(O)O)NC(=O)CNC(=O)c1cc(Cl)ccc1Cl |
| Standard InChI: InChI=1S/C14H19BCl2N2O4/c1-8(2)5-12(15(22)23)19-13(20)7-18-14(21)10-6-9(16)3-4-11(10)17/h3-4,6,8,12,22-23H,5,7H2,1-2H3,(H,18,21)(H,19,20)/t12-/m0/s1 |
| Molecular Formula: C14H19BCl2N2O4 |
Mol. Weight: 360.08148 |
logP: 1.2661 |
| HBD: 4 | HBA: 4 |
| #Rotatable Bonds: 7 | TPSA: 98.66 |