BIMAX1

Chemical Information
| CAS Number | 1105053-45-9 |
| PubChem CID | 171989716 |
| IUPAC Name | (4S)-5-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[(2S)-2-[(2S)-2-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-5-carbamimidamido-1-[[(2S)-1-[[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-carbamimidamido-1-oxopentan-2-yl]carbamoyl]pyrrolidine-1-carbonyl]pyrrolidin-1-yl]-4-carboxy-1-oxobutan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-4-carboxy-1-oxobutan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]-4-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-6-amino-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-5-carbamimidamidopentanoyl]amino]hexanoyl]amino]-5-carbamimidamidopentanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-5-oxopentanoic acid |
| Molecular Formula | C154H254N58O39 |
| Molecular Weight | 3542.0 |
| XLogP | -20.8 |
| Topological Polar Surface Area | 1650 |
| Hydrogen Bond Donor Count | 61 |
| Hydrogen Bond Acceptor Count | 52 |
| Rotatable Bond Count | 128 |
| Heavy Atom Count | 251 |
| Formal Charge | 0 |
| Complexity | 8450 |
| Property | Value |
|---|---|
| Molecular Weight | 3542.0 |
| XLogP3 | -20.8 |
| Hydrogen Bond Donor Count | 61 |
| Hydrogen Bond Acceptor Count | 52 |
| Rotatable Bond Count | 128 |
| Exact Mass | 3540.9708753 |
| Monoisotopic Mass | 3539.9675205 |
| Topological Polar Surface Area | 1650 Ų |
| Heavy Atom Count | 251 |
| Formal Charge | 0 |
| Complexity | 8450 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 26 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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