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| Ligand Name: N-{1-[N-(4-chloro-5-iodo-2-methoxyphenyl)glycyl]piperidin-4-yl}ethenesulfonamide |
| Ligand Type: saccharide |
| Ligand ID: COVPDB108 |
PubChem:
71761630
|
Synonym(s):
- k-ras(g12c) inhibitor 9
- 1469337-91-4
- k-ras inhibitor 9
- n-[1-[2-[(4-chloro-5-iodo-2-methoxyphenyl)amino]acetyl]-4-piperidinyl]ethenesulfonamide
- c16h21clin3o4s
- k-ras(gi2c) inhibitor 9
- gtpl8022
- chembl4278453
- schembl15337776
- aob5260
- hms3653g14
- bcp12230
- 2501ah
- zinc205220330
- ccg-269803
- ncgc00384194-02
- s7332
- sw219243-1
- a14250
- j-008285
- n-(1-{2-[(4-chloro-5-iodo-2-methoxyphenyl)amino]acetyl}piperidin-4-yl)ethene-1-sulfonamide
show 20 synonym(s)
|
| DrugBank: - |
ChEMBL: CHEMBL4278453 |
| Canonical SMILES: COc1cc(Cl)c(I)cc1NCC(=O)N2CCC(CC2)NS(=O)(=O)C=C |
| Standard InChI: InChI=1S/C16H21ClIN3O4S/c1-3-26(23,24)20-11-4-6-21(7-5-11)16(22)10-19-14-9-13(18)12(17)8-15(14)25-2/h3,8-9,11,19-20H,1,4-7,10H2,2H3 |
| Molecular Formula: C16H21ClIN3O4S |
Mol. Weight: 512.9986 |
logP: 2.419 |
| HBD: 2 | HBA: 5 |
| #Rotatable Bonds: 7 | TPSA: 87.74 |