WHO基本药物配体 - 小分子和化合物库

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木霉唑啉
- ≥96%
CAS号 : 526-36-3 Compound CID : 5709

分子式: C₁₆H₂₄N₂ 分子量: 244.37

IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole

SMILES: CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C

InChIKey: HUCJFAOMUPXHDK-UHFFFAOYSA-N

InChI: InChI=1S/C16H24N2/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15/h8-9H,6-7,10H2,1-5H3,(H,17,18)
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氯胍
- ≥96%
CAS号 : 500-92-5 Compound CID : 6178111

分子式: C₁₁H₁₆ClN₅ 分子量: 253.73

IUPAC Name: (1E)-1-[amino-(4-chloroanilino)methylidene]-2-propan-2-ylguanidine

SMILES: CC(C)N=C(N)N=C(N)NC1=CC=C(C=C1)Cl

InChIKey: SSOLNOMRVKKSON-UHFFFAOYSA-N

InChI: InChI=1S/C11H16ClN5/c1-7(2)15-10(13)17-11(14)16-9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H5,13,14,15,16,17)
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四环素
- ≥96%
CAS号 : 60-54-8 Compound CID : 54675776

分子式: C₂₂H₂₄N₂O₈ 分子量: 444.44

IUPAC Name: (4S,4aS,5aS,6S,12aR)-4-(dimethylamino)-1,6,10,11,12a-pentahydroxy-6-methyl-3,12-dioxo-4,4a,5,5a-tetrahydrotetracene-2-carboxamide

SMILES: CC1(C2CC3C(C(=O)C(=C(C3(C(=O)C2=C(C4=C1C=CC=C4O)O)O)O)C(=O)N)N(C)C)O

InChIKey: NWXMGUDVXFXRIG-WESIUVDSSA-N

InChI: InChI=1S/C22H24N2O8/c1-21(31)8-5-4-6-11(25)12(8)16(26)13-9(21)7-10-15(24(2)3)17(27)14(20(23)30)19(29)22(10,32)18(13)28/h4-6,9-10,15,25-26,29,31-32H,7H2,1-3H3,(H2,23,30)/t9-,10-,15-,21+,22-/m0/s1
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