首页
400-620-6333
小分子和化合物库
选项
-
PKI-402CAS号 : 1173204-81-3 Compound CID : 44187953分子式: C29H34N10O3 分子量: 570.65IUPAC Name: 1-[4-(3-ethyl-7-morpholin-4-yltriazolo[4,5-d]pyrimidin-5-yl)phenyl]-3-[4-(4-methylpiperazine-1-carbonyl)phenyl]ureaSMILES: CCN1C2=C(C(=NC(=N2)C3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)C(=O)N5CCN(CC5)C)N6CCOCC6)N=N1InChIKey: ZAXFYGBKZSQBIV-UHFFFAOYSA-NInChI: InChI=1S/C29H34N10O3/c1-3-39-27-24(34-35-39)26(37-16-18-42-19-17-37)32-25(33-27)20-4-8-22(9-5-20)30-29(41)31-23-10-6-21(7-11-23)28(40)38-14-12-36(2)13-15-38/h4-11H,3,12-19H2,1-2H3,(H2,30,31,41)
-
PIK-294CAS号 : 900185-02-6 Compound CID : 24905149分子式: C28H23N7O2 分子量: 489.53IUPAC Name: 2-[[4-amino-3-(3-hydroxyphenyl)pyrazolo[3,4-d]pyrimidin-1-yl]methyl]-5-methyl-3-(2-methylphenyl)quinazolin-4-oneSMILES: CC1=C2C(=CC=C1)N=C(N(C2=O)C3=CC=CC=C3C)CN4C5=NC=NC(=C5C(=N4)C6=CC(=CC=C6)O)NInChIKey: WFSLJOPRIJSOJR-UHFFFAOYSA-NInChI: InChI=1S/C28H23N7O2/c1-16-7-3-4-12-21(16)35-22(32-20-11-5-8-17(2)23(20)28(35)37)14-34-27-24(26(29)30-15-31-27)25(33-34)18-9-6-10-19(36)13-18/h3-13,15,36H,14H2,1-2H3,(H2,29,30,31)
-
塞马西尼CAS号 : 204005-46-9分子式: C15H14N2O 分子量: 238.28IUPAC Name: (3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-1H-indol-2-oneSMILES: CC1=CC(=C(N1)C=C2C3=CC=CC=C3NC2=O)CInChIKey: WUWDLXZGHZSWQZ-WQLSENKSSA-NInChI: InChI=1S/C15H14N2O/c1-9-7-10(2)16-14(9)8-12-11-5-3-4-6-13(11)17-15(12)18/h3-8,16H,1-2H3,(H,17,18)/b12-8-
-
Pilaralisib (XL147)CAS号 : 934526-89-3 Compound CID : 56599306分子式: C25H25ClN6O4S 分子量: 541.02IUPAC Name: 2-amino-N-[3-[[3-(2-chloro-5-methoxyanilino)quinoxalin-2-yl]sulfamoyl]phenyl]-2-methylpropanamideSMILES: CC(C)(C(=O)NC1=CC(=CC=C1)S(=O)(=O)NC2=NC3=CC=CC=C3N=C2NC4=C(C=CC(=C4)OC)Cl)NInChIKey: QINPEPAQOBZPOF-UHFFFAOYSA-NInChI: InChI=1S/C25H25ClN6O4S/c1-25(2,27)24(33)28-15-7-6-8-17(13-15)37(34,35)32-23-22(29-19-9-4-5-10-20(19)30-23)31-21-14-16(36-3)11-12-18(21)26/h4-14H,27H2,1-3H3,(H,28,33)(H,29,31)(H,30,32)
-
BLZ945CAS号 : 953769-46-5(DMSO)分子式: C20H22N4O3S 分子量: 398.48SMILES: CNC(=O)C1=NC=CC(=C1)OC2=CC3=C(C=C2)N=C(NC4CCCCC4O)S3
-
Barasertib (AZD1152-HQPA)CAS号 : 722544-51-6(DMSO)分子式: C26H30FN7O3 分子量: 507.56SMILES: CCN(CCO)CCCOC1=CC=C2C(=NC=NC2=C1)NC3=CC(=N[NH]3)CC(=O)NC4=CC=CC(=C4)F
-
Brivanib (BMS-540215)CAS号 : 649735-46-6(DMSO)分子式: C19H19FN4O3 分子量: 370.38SMILES: CC(O)COC1=C[N]2N=CN=C(OC3=C(F)C4=C([NH]C(=C4)C)C=C3)C2=C1C
-
Idelalisib (CAL-101, GS-1101)CAS号 : 870281-82-6(DMSO)分子式: C22H18FN7O 分子量: 415.42SMILES: CCC(NC1=C2N=C[NH]C2=NC=N1)C3=NC4=CC=CC(=C4C(=O)N3C5=CC=CC=C5)F
-
Agerafenib (RXDX-105)CAS号 : 1188910-76-0(DMSO)分子式: C24H22F3N5O5 分子量: 517.46SMILES: COC1=CC2=NC=NC(=C2C=C1OC)OC3=CC(=CC=C3)NC(=O)NC4=NOC(=C4)C(C)(C)C(F)(F)F
-
CH5132799CAS号 : 1007207-67-1(DMSO)分子式: C15H19N7O3S 分子量: 377.42SMILES: C[S](=O)(=O)N1CCC2=C(N=C(N=C12)N3CCOCC3)C4=CN=C(N)N=C4
-
CP-673451CAS号 : 343787-29-1(DMSO)分子式: C24H27N5O2 分子量: 417.5SMILES: COCCOC1=CC=C2[N](C=NC2=C1)C3=NC4=C(C=CC=C4C=C3)N5CCC(N)CC5
-
Cabozantinib (BMS-907351)CAS号 : 849217-68-1(DMSO)分子式: C28H24FN3O5 分子量: 501.51SMILES: COC1=CC2=C(C=C1OC)C(=CC=N2)OC3=CC=C(NC(=O)C4(CC4)C(=O)NC5=CC=C(F)C=C5)C=C3
