Drug Information
General Information of This Drug
| Drug ID | DRG00128 | |||||
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| Drug Name | 3-Maleimidopropionic acid | |||||
| Synonyms |
3-Maleimidopropionic acid; 7423-55-4; 3-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanoic acid; N-Maleoyl-beta-alanine; 3-(2,5-dioxopyrrol-1-yl)propanoic acid; 1h-pyrrole-1-propanoic acid, 2,5-dihydro-2,5-dioxo-; BMPA Protein Modifier; Maleimide-(CH2)2-COOH; MFCD00043030; N-Maleoyl-.beta.-alanine; 3-(2,5-Dioxo-2,5-dihydro-pyrrol-1-yl)-propionic acid; 2,5-DIHYDRO-2,5-DIOXO-1H-PYRROLE-1-PROPANOIC ACID; 3-Maleimidopropionicacid; N-carboxyethylmaleimide; 3-Maleimidopropanoic acid; Mal-(CH2)2-COOH; Q5C4V9T6GU; N-(2-Carboxyethyl)maleimide; SCHEMBL34464; N-Maleoyl-beta-alanine, 97%; DTXSID00341526; BCP13655; BBL027986; s1127; STK934575; .BETA.-MALEIMIDOPROPIONIC ACID; AKOS000143815; AC-5036; CS-W019611; GS-6614; BP-20452; HY-42145; PD134103; SY021699; DB-023107; AM20100720; FT-0604091; FT-0608194; M1962; N-Maleoyl-beta-alanine, >=98.0% (HPLC); EN300-227402; J-512738; F1265-0534; Z245319606; 3-(2,5-Dioxo-2,5-dihydro-1H-pyrrol-1-yl)propanoic acid #
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| Structure |
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| Formula |
C7H7NO4
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| #Ro5 Violations (Lipinski): 0 | Molecular Weight (mw) | 169.13 | ||||
| Lipid-water partition coefficient (xlogp) | 0 | |||||
| Hydrogen Bond Donor Count (hbonddonor) | 1 | |||||
| Hydrogen Bond Acceptor Count (hbondacc) | 4 | |||||
| Rotatable Bond Count (rotbonds) | 3 | |||||
| PubChem CID | ||||||
| Canonical smiles |
C1=CC(=O)N(C1=O)CCC(=O)O
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| InChI |
InChI=1S/C7H7NO4/c9-5-1-2-6(10)8(5)4-3-7(11)12/h1-2H,3-4H2,(H,11,12)
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| InChIKey |
IUTPJBLLJJNPAJ-UHFFFAOYSA-N
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| IUPAC Name |
3-(2,5-dioxopyrrol-1-yl)propanoic acid
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