Diiodohydantoin · CAS 2232-12-4 · C3H2I2N2O2. InChIKey JKZOMQGCLXJWFO-UHFFFAOYSA-N. Identification CAS Registry Number2232-12-4PubChem CID67212486Molecular formulaC3H2I2N2O2IUPAC name5,5-diiodoimidazolidine-2,4-dioneInChIKeyJKZOMQGCLXJWFO-UHFFFAOYSA-N Computed Descriptors Molecular Weight351.87Hydrogen Bond Donor Count2Hydrogen…
Dibromohydantoin · CAS 77-48-5 · C3H2Br2N2O2. InChIKey MENYRYNFSIBDQN-UHFFFAOYSA-N. Identification CAS Registry Number77-48-5PubChem CID54068228Molecular formulaC3H2Br2N2O2IUPAC name5,5-dibromoimidazolidine-2,4-dioneInChIKeyMENYRYNFSIBDQN-UHFFFAOYSA-N Computed Descriptors Molecular Weight257.87Hydrogen Bond Donor Count2Hydrogen…
Theacrine · CAS 2309-49-1 · C9H12N4O3. InChIKey QGDOQULISIQFHQ-UHFFFAOYSA-N. Identification CAS Registry Number2309-49-1PubChem CID75324Molecular formulaC9H12N4O3IUPAC name1,3,7,9-tetramethylpurine-2,6,8-trioneInChIKeyQGDOQULISIQFHQ-UHFFFAOYSA-N Computed Descriptors Molecular Weight224.22Hydrogen Bond Donor Count0Hydrogen…
Aluminum Glycinate · CAS 52729-29-0 · C6H12AlN3O6. InChIKey RUJUQAPQALJUPC-UHFFFAOYSA-K. Identification CAS Registry Number52729-29-0PubChem CID6452712Molecular formulaC6H12AlN3O6IUPAC namealuminum tris(2-aminoacetate)InChIKeyRUJUQAPQALJUPC-UHFFFAOYSA-K Computed Descriptors Molecular Weight249.16Hydrogen Bond…
Calcium Isocaprylate · CAS 136-51-6 · C16H30CaO4. InChIKey LTPCXXMGKDQPAO-UHFFFAOYSA-L. Identification CAS Registry Number136-51-6PubChem CID61082Molecular formulaC16H30CaO4IUPAC namecalcium bis(2-ethylhexanoate)InChIKeyLTPCXXMGKDQPAO-UHFFFAOYSA-L Computed Descriptors Molecular Weight326.48Hydrogen Bond…
Calcium Acetyl Taurate · CAS 69538-63-2 · C8H16CaN2O8S2. InChIKey XCVJUIGEYFWJLC-UHFFFAOYSA-L. Identification CAS Registry Number69538-63-2PubChem CID20521520Molecular formulaC8H16CaN2O8S2IUPAC namecalcium bis(2-acetamidoethanesulfonate)InChIKeyXCVJUIGEYFWJLC-UHFFFAOYSA-L Computed Descriptors Molecular Weight372.4Hydrogen…
Calcium Taurate · CAS not separately registered in PubChem · C4H12CaN2O6S2. InChIKey QRCOITRESWXMIX-UHFFFAOYSA-L. Identification CAS Registry Number—PubChem CID9947880Molecular formulaC4H12CaN2O6S2IUPAC namecalcium bis(2-aminoethanesulfonate)InChIKeyQRCOITRESWXMIX-UHFFFAOYSA-L Computed…
Aprotinin · CAS 9087-70-1 · C284H432N84O79S7. UNII 04XPW8C0FL. Melting Point: >100 °C. Identification CAS Registry Number9087-70-1PubChem CID16130295Molecular formulaC284H432N84O79S7UNII (FDA)04XPW8C0FL Computed Descriptors Molecular…
MEGA-10 · CAS 85261-20-7 · C17H35NO6. UNII 9Q27ZA5M8G. Identification CAS Registry Number85261-20-7PubChem CID174432Molecular formulaC17H35NO6IUPAC nameN-methyl-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]decanamideUNII (FDA)9Q27ZA5M8G Computed Descriptors Molecular Weight349.5XLogP30.6Hydrogen Bond Donor…
Bovine Serum Albumin · CAS 9048-46-8 · MW 66430.00 g/mol. Amino acid residues: 583; Molecular mass: 66.5 kDa (66,430 Da); Isoelectric point:…
RNase A · CAS 9001-99-4 · C9H14N4O3. UNII NS00014799. Identification CAS Registry Number9001-99-4PubChem CID9369Molecular formulaC9H14N4O3IUPAC name2-(3-aminopropanoylamino)-3-(1H-imidazol-5-yl)propanoic acidUNII (FDA)NS00014799 Computed Descriptors Molecular Weight226.23XLogP3-4Hydrogen…
1-Naphthyl Acetate · CAS 830-81-9 · C12H10O2. Vapor Pressure: 0.000761 [mmHg]; LogP: 2.78. Identification CAS Registry Number830-81-9PubChem CID13247Molecular formulaC12H10O2IUPAC namenaphthalen-1-yl acetate Computed…
MEGA-8 · CAS 85316-98-9 · C15H31NO6. UNII P3TDB90KLN. Identification CAS Registry Number85316-98-9PubChem CID160091Molecular formulaC15H31NO6IUPAC nameN-methyl-N-[(2S,3R,4R,5R)-2,3,4,5,6-pentahydroxyhexyl]octanamideUNII (FDA)P3TDB90KLN Computed Descriptors Molecular Weight321.41XLogP3-0.4Hydrogen Bond Donor…
MAOS · CAS 82692-97-5 · C13H20NNaO4S. Identification CAS Registry Number82692-97-5PubChem CID53393748Molecular formulaC13H20NNaO4SIUPAC namesodium 3-(N-ethyl-3,5-dimethylanilino)-2-hydroxypropane-1-sulfonate Computed Descriptors Molecular Weight309.36Hydrogen Bond Donor Count1Hydrogen Bond…
Diatrizoate Sodium · CAS 737-31-5 · C11H8I3N2NaO4. UNII V5403H8VG7. Melting Point: 261-262 °C (decomposes). Identification CAS Registry Number737-31-5PubChem CID23672589Molecular formulaC11H8I3N2NaO4IUPAC namesodium 3,5-diacetamido-2,4,6-triiodobenzoateUNII…
TOOS · CAS 82692-93-1 · C12H18NNaO4S. Identification CAS Registry Number82692-93-1PubChem CID23676159Molecular formulaC12H18NNaO4SIUPAC namesodium 3-(N-ethyl-3-methylanilino)-2-hydroxypropane-1-sulfonate Computed Descriptors Molecular Weight295.33Hydrogen Bond Donor Count1Hydrogen Bond…
AMPSO · CAS 68399-79-1 · C7H17NO5S. UNII NS00062538. Identification CAS Registry Number68399-79-1PubChem CID100211Molecular formulaC7H17NO5SIUPAC name2-hydroxy-3-[(1-hydroxy-2-methylpropan-2-yl)amino]propane-1-sulfonic acidUNII (FDA)NS00062538 Computed Descriptors Molecular Weight227.28XLogP3-4.3Hydrogen Bond…
2',7'-Dichlorofluorescein · CAS 76-54-0 · C20H10Cl2O5. UNII 56NQM5UZT1. Identification CAS Registry Number76-54-0PubChem CID64944Molecular formulaC20H10Cl2O5IUPAC name2',7'-dichloro-3',6'-dihydroxyspiro[2-benzofuran-3,9'-xanthene]-1-oneUNII (FDA)56NQM5UZT1 Computed Descriptors Molecular Weight401.2XLogP34.7Hydrogen Bond Donor…
EGTA · CAS 67-42-5 · C14H24N2O10. UNII 526U7A2651. Identification CAS Registry Number67-42-5PubChem CID6207Molecular formulaC14H24N2O10IUPAC name2-[2-[2-[2-[bis(carboxymethyl)amino]ethoxy]ethoxy]ethyl-(carboxymethyl)amino]acetic acidUNII (FDA)526U7A2651 Computed Descriptors Molecular Weight380.35XLogP3-6.2Hydrogen Bond…
CHAPS · CAS 75621-03-3 · C32H58N2O7S. UNII QBP25342AG. Identification CAS Registry Number75621-03-3PubChem CID107670Molecular formulaC32H58N2O7SIUPAC name3-[dimethyl-[3-[[(4R)-4-[(3R,5S,7R,8R,9S,10S,12S,13R,14S,17R)-3,7,12-trihydroxy-10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoyl]amino]propyl]azaniumyl]propane-1-sulfonateUNII (FDA)QBP25342AG Computed Descriptors Molecular Weight614.9XLogP32.9Hydrogen Bond Donor…
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