Targets

Cas#: 918505-61-0(DMSO)       

Formula:  C₂₂H₁₈F₂N₄O₃S        Molecular Weight: 456.47

SMILES: CC(C)S(=O)(NC1=CC=C(C(C(C2=CNC3=NC=C(C=C32)C4=CC=CN=C4)=O)=C1F)F)=O

Cas#: 185351-23-9(DMSO)       

Formula:  C₂₁H₁₅ClN₂O₄        Molecular Weight: 394.81

SMILES: ClC(C(C1=C(C=CC=C1)C2=O)=O)=C2N[C@H](C(O)=O)CC3=CNC4=C3C=CC=C4

Cas#: 36752-54-2       

Formula:  C₂₁H₃₂O₃        Molecular Weight: 332.48

IUPAC Name: (E)-1-(4-hydroxy-3-methoxyphenyl)tetradec-4-en-3-one

SMILES: CCCCCCCCC/C=C/C(=O)CCC1=CC(=C(C=C1)O)OC

InChIKey: FADFGCOCHHNRHF-VAWYXSNFSA-N

InChI: InChI=1S/C21H32O3/c1-3-4-5-6-7-8-9-10-11-12-19(22)15-13-18-14-16-20(23)21(17-18)24-2/h11-12,14,16-17,23H,3-10,13,15H2,1-2H3/b12-11+

Cas#: 5711-29-5       

Formula:  CH₃(CH₂)₇CD=CD(CH₂)₇CO₂H        Molecular Weight: 284.47

IUPAC Name: (Z)-9,10-dideuteriooctadec-9-enoic acid

SMILES: CCCCCCCCC=CCCCCCCCC(=O)O

InChIKey: ZQPPMHVWECSIRJ-FGFBQCSHSA-N

InChI: InChI=1S/C18H34O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h9-10H,2-8,11-17H2,1H3,(H,19,20)/b10-9-/i9D,10D

Cas#: 36700-45-5       

Formula:  C₁₉H₂₈O₃        Molecular Weight: 304.42

IUPAC Name: (E)-1-(4-hydroxy-3-methoxyphenyl)dodec-4-en-3-one

SMILES: CCCCCCCC=CC(=O)CCC1=CC(=C(C=C1)O)OC

InChIKey: LGZSMXJRMTYABD-MDZDMXLPSA-N

InChI: InChI=1S/C19H28O3/c1-3-4-5-6-7-8-9-10-17(20)13-11-16-12-14-18(21)19(15-16)22-2/h9-10,12,14-15,21H,3-8,11,13H2,1-2H3/b10-9+

Formula:  C₁₄H₂₉IO₇        Molecular Weight: 436.28

SMILES: ICCOCCOCCOCCOCCOCCOCCO

Formula:  C₂₂H₃₇F₃N₁₀O₁₀S₂        Molecular Weight: 394.43

Cas#: 2466-09-3        Compound CID:  1023

Formula:  (HO)₂P(O)OP(O)(OH)₂        Molecular Weight: 177.98

IUPAC Name: phosphono dihydrogen phosphate

SMILES: OP(=O)(O)OP(=O)(O)O

InChIKey: XPPKVPWEQAFLFU-UHFFFAOYSA-N

InChI: InChI=1S/H4O7P2/c1-8(2,3)7-9(4,5)6/h(H2,1,2,3)(H2,4,5,6)

Cas#: 503612-47-3        Compound CID:  10182969

Formula:  C₂₅H₂₅N₅O₄        Molecular Weight: 459.51

IUPAC Name: 1-(4-methoxyphenyl)-7-oxo-6-[4-(2-oxopiperidin-1-yl)phenyl]-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxamide

SMILES: COC1=CC=C(C=C1)N2C3=C(CCN(C3=O)C4=CC=C(C=C4)N5CCCCC5=O)C(=N2)C(=O)N

InChIKey: QNZCBYKSOIHPEH-UHFFFAOYSA-N

InChI: InChI=1S/C25H25N5O4/c1-34-19-11-9-18(10-12-19)30-23-20(22(27-30)24(26)32)13-15-29(25(23)33)17-7-5-16(6-8-17)28-14-3-2-4-21(28)31/h5-12H,2-4,13-15H2,1H3,(H2,26,32)

Cas#: 128007-31-8       

Formula:  C₂₈H₄₁NO₃        Molecular Weight: 439.64

IUPAC Name: (5Z,8Z,11Z,14Z)-N-[(4-hydroxy-3-methoxyphenyl)methyl]icosa-5,8,11,14-tetraenamide

SMILES: CCCCCC=CCC=CCC=CCC=CCCCC(=O)NCC1=CC(=C(C=C1)O)OC

InChIKey: QVLMCRFQGHWOPM-ZKWNWVNESA-N

InChI: InChI=1S/C28H41NO3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28(31)29-24-25-21-22-26(30)27(23-25)32-2/h7-8,10-11,13-14,16-17,21-23,30H,3-6,9,12,15,18-20,24H2,1-2H3,(H,29,31)/b8-7-,11-10-,14-13-,17-16-

Cas#: 56985-40-1        Compound CID:  5311493

Formula:  C₂₁H₃₄O₄        Molecular Weight: 350.49

IUPAC Name: (Z)-7-[(1R,4S,5S,6R)-6-[(E,3S)-3-hydroxyoct-1-enyl]-2-oxabicyclo[2.2.1]heptan-5-yl]hept-5-enoic acid

SMILES: CCCCCC(C=CC1C2CC(C1CC=CCCCC(=O)O)CO2)O

InChIKey: LQANGKSBLPMBTJ-BRSNVKEHSA-N

InChI: InChI=1S/C21H34O4/c1-2-3-6-9-17(22)12-13-19-18(16-14-20(19)25-15-16)10-7-4-5-8-11-21(23)24/h4,7,12-13,16-20,22H,2-3,5-6,8-11,14-15H2,1H3,(H,23,24)/b7-4-,13-12+/t16-,17+,18+,19-,20-/m1/s1

Cas#: 54845-95-3       

Formula:  C₂₀H₃₂O₃        Molecular Weight: 320.47

IUPAC Name: (5Z,8Z,11Z,13E,15S)-15-hydroxyicosa-5,8,11,13-tetraenoic acid

SMILES: CCCCCC(C=CC=CCC=CCC=CCCCC(=O)O)O

InChIKey: JSFATNQSLKRBCI-VAEKSGALSA-N

InChI: InChI=1S/C20H32O3/c1-2-3-13-16-19(21)17-14-11-9-7-5-4-6-8-10-12-15-18-20(22)23/h4-5,8-11,14,17,19,21H,2-3,6-7,12-13,15-16,18H2,1H3,(H,22,23)/b5-4-,10-8-,11-9-,17-14+/t19-/m0/s1