配体家族 - 小分子和化合物库

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8-甲氧基补骨脂素
- ≥98%
CAS号: 298-81-7 EC号: 206-066-9

分子式: C₁₂H₈O₄ 分子量: 216.19

IUPAC Name: 9-methoxyfuro[3,2-g]chromen-7-one

SMILES: COC1=C2C(=CC3=C1OC=C3)C=CC(=O)O2

InChIKey: QXKHYNVANLEOEG-UHFFFAOYSA-N

InChI: 1S/C12H8O4/c1-14-12-10-8(4-5-15-10)6-7-2-3-9(13)16-11(7)12/h2-6H,1H3
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尼可地尔
- ≥98%(HPLC)
CAS号: 65141-46-0

分子式: C₈H₉N₃O₄ 分子量: 211.17

IUPAC Name: 2-(pyridine-3-carbonylamino)ethyl nitrate

SMILES: C1=CC(=CN=C1)C(=O)NCCO[N+](=O)[O-]

InChIKey: LBHIOVVIQHSOQN-UHFFFAOYSA-N

InChI: 1S/C8H9N3O4/c12-8(7-2-1-3-9-6-7)10-4-5-15-11(13)14/h1-3,6H,4-5H2,(H,10,12)
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卡巴拉汀
- ≥99%
CAS号: 123441-03-2 Compound CID : 77991

分子式: C₁₄H₂₂N₂O₂ 分子量: 250.34

IUPAC Name: [3-[(1S)-1-(dimethylamino)ethyl]phenyl] N-ethyl-N-methylcarbamate

SMILES: CCN(C)C(=O)OC1=CC=CC(=C1)C(C)N(C)C

InChIKey: XSVMFMHYUFZWBK-NSHDSACASA-N

InChI: 1S/C14H22N2O2/c1-6-16(5)14(17)18-13-9-7-8-12(10-13)11(2)15(3)4/h7-11H,6H2,1-5H3/t11-/m0/s1
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甲苯磺丁脲
- ≥99%
CAS号: 64-77-7 Compound CID : 5505

分子式: C₁₂H₁₈N₂O₃S 分子量: 270.35

IUPAC Name: 1-butyl-3-(4-methylphenyl)sulfonylurea

SMILES: CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)C

InChIKey: JLRGJRBPOGGCBT-UHFFFAOYSA-N

InChI: 1S/C12H18N2O3S/c1-3-4-9-13-12(15)14-18(16,17)11-7-5-10(2)6-8-11/h5-8H,3-4,9H2,1-2H3,(H2,13,14,15)
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甲基硫酸新斯的明
- ≥98%
CAS号: 51-60-5 EC号: 200-109-5

分子式: C₁₃H₂₂N₂O₆S 分子量: 334.39

IUPAC Name: [3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium;methyl sulfate

SMILES: CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.COS(=O)(=O)[O-]

InChIKey: OSZNNLWOYWAHSS-UHFFFAOYSA-M

InChI: 1S/C12H19N2O2.CH4O4S/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;1-5-6(2,3)4/h6-9H,1-5H3;1H3,(H,2,3,4)/q+1;/p-1
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盐酸多奈哌齐
- ≥98%
CAS号: 120011-70-3

分子式: C₂₄H₂₉NO₃·HCl 分子量: 415.96

IUPAC Name: 2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimethoxy-2,3-dihydroinden-1-one;hydrochloride

SMILES: COC1=C(C=C2C(=C1)CC(C2=O)CC3CCN(CC3)CC4=CC=CC=C4)OC.Cl

InChIKey: XWAIAVWHZJNZQQ-UHFFFAOYSA-N

InChI: 1S/C24H29NO3.ClH/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18;/h3-7,14-15,17,20H,8-13,16H2,1-2H3;1H
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二氮嗪
- ≥98%
CAS号: 364-98-7 EC号: 206-668-1

分子式: C₈H₇ClN₂O₂S 分子量: 230.67

IUPAC Name: 7-chloro-3-methyl-4H-1λ6,2,4-benzothiadiazine 1,1-dioxide

SMILES: CC1=NS(=O)(=O)C2=C(N1)C=CC(=C2)Cl

InChIKey: GDLBFKVLRPITMI-UHFFFAOYSA-N

InChI: 1S/C8H7ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-4H,1H3,(H,10,11)
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格列本脲
- ≥99%
CAS号: 10238-21-8 EC号: 233-570-6

分子式: C₂₃H₂₈ClN₃O₅S 分子量: 494

IUPAC Name: 5-chloro-N-[2-[4-(cyclohexylcarbamoylsulfamoyl)phenyl]ethyl]-2-methoxybenzamide

SMILES: COC1=C(C=C(C=C1)Cl)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)NC(=O)NC3CCCCC3

InChIKey: ZNNLBTZKUZBEKO-UHFFFAOYSA-N

InChI: 1S/C23H28ClN3O5S/c1-32-21-12-9-17(24)15-20(21)22(28)25-14-13-16-7-10-19(11-8-16)33(30,31)27-23(29)26-18-5-3-2-4-6-18/h7-12,15,18H,2-6,13-14H2,1H3,(H,25,28)(H2,26,27,29)
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米诺地尔
- ≥98%(HPLC)(T)
CAS号: 38304-91-5

分子式: C₉H₁₅N₅O 分子量: 209.25

IUPAC Name: 3-hydroxy-2-imino-6-piperidin-1-ylpyrimidin-4-amine

SMILES: C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O

InChIKey: ZIMGGGWCDYVHOY-UHFFFAOYSA-N

InChI: 1S/C9H15N5O/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h6,11,15H,1-5,10H2
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溴化新斯的明
- ≥99%(T)
CAS号: 114-80-7

分子式: C₁₂H₁₉BrN₂O₂ 分子量: 303.2

IUPAC Name: [3-(dimethylcarbamoyloxy)phenyl]-trimethylazanium;bromide

SMILES: CN(C)C(=O)OC1=CC=CC(=C1)[N+](C)(C)C.[Br-]

InChIKey: LULNWZDBKTWDGK-UHFFFAOYSA-M

InChI: 1S/C12H19N2O2.BrH/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5;/h6-9H,1-5H3;1H/q+1;/p-1
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Ipidacrine
CAS号: 62732-44-9 Compound CID : 604519

分子式: C₁₂H₁₆N₂ 分子量: 188.274

IUPAC Name: 2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinolin-9-amine

SMILES: C1CCC2=C(C1)C(=C3CCCC3=N2)N

InChIKey: YLUSMKAJIQOXPV-UHFFFAOYSA-N

InChI: 1S/C12H16N2/c13-12-8-4-1-2-6-10(8)14-11-7-3-5-9(11)12/h1-7H2,(H2,13,14)

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GNE-900
CAS号: 1200126-26-6 Compound CID : 44545757

分子式: C₂₃H₂₁N₅ 分子量: 367.45

IUPAC Name: 12-[4-(piperidin-1-ylmethyl)phenyl]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile

SMILES: C1CCN(CC1)CC2=CC=C(C=C2)C3=CC4=C(NC5=C4C=C(N=C5)C#N)N=C3

InChIKey: PPYHOOZGDDPLKM-UHFFFAOYSA-N

InChI: 1S/C23H21N5/c24-12-19-11-20-21-10-18(13-26-23(21)27-22(20)14-25-19)17-6-4-16(5-7-17)15-28-8-2-1-3-9-28/h4-7,10-11,13-14H,1-3,8-9,15H2,(H,26,27)

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