激动剂、拮抗剂和抑制剂-生物科学-阿拉丁aladdin

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PKI-402
- ≥98%
CAS号 : 1173204-81-3 Compound CID : 44187953

分子式: C₂₉H₃₄N₁₀O₃ 分子量: 570.65

IUPAC Name: 1-[4-(3-ethyl-7-morpholin-4-yltriazolo[4,5-d]pyrimidin-5-yl)phenyl]-3-[4-(4-methylpiperazine-1-carbonyl)phenyl]urea

SMILES: CCN1C2=C(C(=NC(=N2)C3=CC=C(C=C3)NC(=O)NC4=CC=C(C=C4)C(=O)N5CCN(CC5)C)N6CCOCC6)N=N1

InChIKey: ZAXFYGBKZSQBIV-UHFFFAOYSA-N

InChI: 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)
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WYE-125132(WYE-132),ATP竞争性mTOR抑制剂
- ≥98%
CAS号 : 1144068-46-1 Compound CID : 25260757

分子式: C₂₇H₃₃N₇O₄ 分子量: 519.61

IUPAC Name: 1-[4-[1-(1,4-dioxaspiro[4.5]decan-8-yl)-4-(8-oxa-3-azabicyclo[3.2.1]octan-3-yl)pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]-3-methylurea

SMILES: CNC(=O)NC1=CC=C(C=C1)C2=NC3=C(C=NN3C4CCC5(CC4)OCCO5)C(=N2)N6CC7CCC(C6)O7

InChIKey: QLHHRYZMBGPBJG-UHFFFAOYSA-N

InChI: InChI=1S/C27H33N7O4/c1-28-26(35)30-18-4-2-17(3-5-18)23-31-24(33-15-20-6-7-21(16-33)38-20)22-14-29-34(25(22)32-23)19-8-10-27(11-9-19)36-12-13-37-27/h2-5,14,19-21H,6-13,15-16H2,1H3,(H2,28,30,35)
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WAY-600
- ≥98%
CAS号 : 1062159-35-6 Compound CID : 25229526

分子式: C₂₈H₃₀N₈O 分子量: 494.59

IUPAC Name: 4-[6-(1H-indol-5-yl)-1-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[3,4-d]pyrimidin-4-yl]morpholine

SMILES: C1CN(CCC1N2C3=C(C=N2)C(=NC(=N3)C4=CC5=C(C=C4)NC=C5)N6CCOCC6)CC7=CN=CC=C7

InChIKey: FPEIJQLXFHKLJV-UHFFFAOYSA-N

InChI: InChI=1S/C28H30N8O/c1-2-20(17-29-8-1)19-34-10-6-23(7-11-34)36-28-24(18-31-36)27(35-12-14-37-15-13-35)32-26(33-28)22-3-4-25-21(16-22)5-9-30-25/h1-5,8-9,16-18,23,30H,6-7,10-15,19H2
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WYE-687,mTOR抑制剂
- ≥98%
CAS号 : 1062161-90-3 Compound CID : 25229450

分子式: C₂₈H₃₂N₈O₃ 分子量: 528.61

IUPAC Name: methyl N-[4-[4-morpholin-4-yl-1-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]carbamate

SMILES: COC(=O)NC1=CC=C(C=C1)C2=NC3=C(C=NN3C4CCN(CC4)CC5=CN=CC=C5)C(=N2)N6CCOCC6

InChIKey: VDOCQQKGPJENHJ-UHFFFAOYSA-N

InChI: InChI=1S/C28H32N8O3/c1-38-28(37)31-22-6-4-21(5-7-22)25-32-26(35-13-15-39-16-14-35)24-18-30-36(27(24)33-25)23-8-11-34(12-9-23)19-20-3-2-10-29-17-20/h2-7,10,17-18,23H,8-9,11-16,19H2,1H3,(H,31,37)
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ETP-46464,mTOR 和 ATR 抑制剂
- ≥98%
CAS号 : 1345675-02-6 Compound CID : 72199292

分子式: C₃₀H₂₂N₄O₂ 分子量: 470.52

IUPAC Name: 2-methyl-2-[4-(2-oxo-9-quinolin-3-yl-4H-[1,3]oxazino[5,4-c]quinolin-1-yl)phenyl]propanenitrile

SMILES: CC(C)(C#N)C1=CC=C(C=C1)N2C3=C4C=C(C=CC4=NC=C3COC2=O)C5=CC6=CC=CC=C6N=C5

InChIKey: DPLMXAYKJZOTKO-UHFFFAOYSA-N

InChI: InChI=1S/C30H22N4O2/c1-30(2,18-31)23-8-10-24(11-9-23)34-28-22(17-36-29(34)35)16-33-27-12-7-19(14-25(27)28)21-13-20-5-3-4-6-26(20)32-15-21/h3-16H,17H2,1-2H3
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GSK3787,不可逆的PPARδ拮抗剂
- ≥98%
CAS号 : 188591-46-0 Compound CID : 2800647

分子式: C₁₅H₁₂ClF₃N₂O₃S 分子量: 392.78

IUPAC Name: 4-chloro-N-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl]benzamide

SMILES: C1=CC(=CC=C1C(=O)NCCS(=O)(=O)C2=NC=C(C=C2)C(F)(F)F)Cl

InChIKey: JFUIMTGOQCQTPF-UHFFFAOYSA-N

InChI: InChI=1S/C15H12ClF3N2O3S/c16-12-4-1-10(2-5-12)14(22)20-7-8-25(23,24)13-6-3-11(9-21-13)15(17,18)19/h1-6,9H,7-8H2,(H,20,22)
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GDC-0349
- ≥99%
CAS号 : 1207360-89-1 Compound CID : 59239165

分子式: C₂₄H₃₂N₆O₃ 分子量: 452.55

IUPAC Name: 1-ethyl-3-[4-[4-[(3S)-3-methylmorpholin-4-yl]-7-(oxetan-3-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]phenyl]urea

SMILES: CCNC(=O)NC1=CC=C(C=C1)C2=NC3=C(CCN(C3)C4COC4)C(=N2)N5CCOCC5C

InChIKey: RGJOJUGRHPQXGF-INIZCTEOSA-N

InChI: InChI=1S/C24H32N6O3/c1-3-25-24(31)26-18-6-4-17(5-7-18)22-27-21-12-29(19-14-33-15-19)9-8-20(21)23(28-22)30-10-11-32-13-16(30)2/h4-7,16,19H,3,8-15H2,1-2H3,(H2,25,26,31)/t16-/m0/s1
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CAY10626,有效的PI3Kα/ mTOR抑制剂
- ≥98%
CAS号 : 1202884-94-3 Compound CID : 44599690

分子式: C₃₁H₃₅F₃N₈O₃ 分子量: 624.66

IUPAC Name: N-[2-(dimethylamino)ethyl]-N-methyl-4-[[4-[4-morpholin-4-yl-7-(2,2,2-trifluoroethyl)pyrrolo[2,3-d]pyrimidin-2-yl]phenyl]carbamoylamino]benzamide

SMILES: CN(C)CCN(C)C(=O)C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C3=NC4=C(C=CN4CC(F)(F)F)C(=N3)N5CCOCC5

InChIKey: GMASZVAHNYVURN-UHFFFAOYSA-N

InChI: InChI=1S/C31H35F3N8O3/c1-39(2)14-15-40(3)29(43)22-6-10-24(11-7-22)36-30(44)35-23-8-4-21(5-9-23)26-37-27(41-16-18-45-19-17-41)25-12-13-42(28(25)38-26)20-31(32,33)34/h4-13H,14-20H2,1-3H3,(H2,35,36,44)
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PKI-179
- ≥98%
CAS号 : 1197160-28-3 Compound CID : 46947264

分子式: C₂₅H₂₈N₈O₃ 分子量: 488.54

IUPAC Name: 1-[4-[4-morpholin-4-yl-6-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)-1,3,5-triazin-2-yl]phenyl]-3-pyridin-4-ylurea

SMILES: C1CC2COCC1N2C3=NC(=NC(=N3)N4CCOCC4)C5=CC=C(C=C5)NC(=O)NC6=CC=NC=C6

InChIKey: WXUUCRLKXQMWRY-UHFFFAOYSA-N

InChI: InChI=1S/C25H28N8O3/c34-25(28-19-7-9-26-10-8-19)27-18-3-1-17(2-4-18)22-29-23(32-11-13-35-14-12-32)31-24(30-22)33-20-5-6-21(33)16-36-15-20/h1-4,7-10,20-21H,5-6,11-16H2,(H2,26,27,28,34)
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Vistusertib (AZD2014)
- 10mM in DMSO
CAS号 : 1009298-59-2(DMSO)

分子式: C₂₅H₃₀N₆O₃ 分子量: 462.54

SMILES: CNC(=O)C1=CC=CC(=C1)C2=CC=C3C(=N2)N=C(N=C3N4CCOCC4C)N5CCOCC5C
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AZD8055
- 10mM in DMSO
CAS号 : 1009298-09-2(DMSO)

分子式: C₂₅H₃₁N₅O₄ 分子量: 465.54

SMILES: COC1=C(CO)C=C(C=C1)C2=NC3=C(C=C2)C(=NC(=N3)N4CCOCC4C)N5CCOCC5C
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Buparlisib (BKM120)
- 10mM in DMSO
CAS号 : 944396-07-0(DMSO)

分子式: C₁₈H₂₁F₃N₆O₂ 分子量: 410.39

SMILES: NC1=CC(=C(C=N1)C2=NC(=NC(=C2)N3CCOCC3)N4CCOCC4)C(F)(F)F
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