Ligand
Ligand Name:   AMG 510
Ligand Type:   non-polymer
Ligand ID:   COVPDB1100 PubChem:   137278711
Synonym(s):  
  •   amg-510
  • amg510
  • amg-510 racemate
  • sotorasib
  • 2252403-56-6
  • kras g12c inhibitor 9
  • 2296729-00-3
  • unii-2b2vm6uc8g
  • 2b2vm6uc8g
  • chembl4535757
  • 2296729-00-3 (racemate)
  • 4-((s)-4-acryloyl-2-methylpiperazin-1-yl)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(2-isopropyl-4-methylpyridin-3-yl)pyrido[2,3-d]pyrimidin-2(1h)-one
  • 6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(4-methyl-2-propan-2-ylpyridin-3-yl)-4-[(2s)-2-methyl-4-prop-2-enoylpiperazin-1-yl]pyrido[2,3-d]pyrimidin-2-one
  • sotorasib [inn]
  • 6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(4-methyl-2-propan-2-ylpyridin-3-yl)-4-((2s)-2-methyl-4-prop-2-enoylpiperazin-1-yl)pyrido(2,3-d)pyrimidin-2-one
  • amg510 racemate
  • sotorasib [usan]
  • amg-510(racemate)
  • kras mutant-targeting amg 510
  • schembl20560375
  • gtpl10678
  • amg 510 pound>>amg-510
  • amy16918
  • bcp30452
  • bcp33368
  • ex-a3538
  • bdbm50514402
  • nsc818433
  • s8830
  • who 11370
  • db15569
  • nsc-818433
  • bs-16684
  • hy-114277
  • cs-0081316
  • compound (r)-38 [pmid: 31820981]
  • amg510 ; amg 510; amg-510; amg510
  • (1m)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(4-methyl-2-(propan-2-yl)pyridin-3-yl)-4-((2s)-2-methyl-4-(prop-2-enoyl)piperazin-1-yl)pyrido(2,3-d)pyrimidin-2(1h)-one
  • (1s)-4-((s)-4-acryloyl-2-methylpiperazin-1-yl)-6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(2-isopropyl-4-methylpyridin-3-yl)pyrido[2,3-d]pyrimidin-2(1h)-one
  • 2296729-66-1
  • pyrido(2,3-d)pyrimidin-2(1h)-one, 6-fluoro-7-(2-fluoro-6-hydroxyphenyl)-1-(4-methyl-2-(1-methylethyl)-3-pyridinyl)-4-((2s)-2-methyl-4-(1-oxo-2-propen-1-yl)-1-piperazinyl)-
show 40 synonym(s)
DrugBank:   DB15569 ChEMBL:   CHEMBL4535757
Canonical SMILES:   Fc1cccc(O)c1-c(n2)c(F)cc(c23)c(N4CCN(C[C@@H]4C)C(=O)C=C)nc(=O)n3-c5c(C)ccnc5C(C)C
Standard InChI:   InChI=1S/C30H30F2N6O3/c1-6-23(40)36-12-13-37(18(5)15-36)28-19-14-21(32)26(24-20(31)8-7-9-22(24)39)34-29(19)38(30(41)35-28)27-17(4)10-11-33-25(27)16(2)3/h6-11,14,16,18,39H,1,12-13,15H2,2-5H3/t18-/m0/s1
Molecular Formula:   C30H30F2N6O3 Mol. Weight:   560.23474 logP:   4.48142
HBD:   1 HBA:   8
#Rotatable Bonds:   5 TPSA:   104.45

Bound Proteins
Protein Name Uniprot ID/ACC Organism PDB ID HET Code Binding Affinity Binding Database Complex Card
GTPase KRas P01116 (RASK_HUMAN) Homo sapiens (Human) 6OIM MOV
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