GP100 Imdqvpfsv
Basic information
- Standard SMILES
CCC(C)C(N)C(=O)NC(CCSC)C(=O)NC(CC(=O)O)C(=O)NC(CCC(N)=O)C(=O)NC(C(=O)N1CCCC1C(=O)NC(Cc1ccccc1)C(=O)NC(CO)C(=O)NC(C(=O)O)C(C)C)C(C)C- InChIKey
BDQMCYCLZBSYJZ-UHFFFAOYSA-N- Molecular formula
- C47H74N10O14S
- Average molar mass
- 1,035.2 g/mol
- Monoisotopic mass
- 1,034.51066825
Names & identifiers
- Preferred name
- GP100 Imdqvpfsv
- IUPAC
- 2-[[2-[[2-[[1-[2-[[5-amino-2-[[2-[[2-[(2-amino-3-methylpentanoyl)amino]-4-methylsulfanylbutanoyl]amino]-3-carboxypropanoyl]amino]-5-oxopentanoyl]amino]-3-methylbutanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]amino]-3-methylbutanoic acid
Names & synonyms
NSC683472GP100 IMDQVPFSVorb1685446SCHEMBL30930134AKOS040759233NSC-683472DS-017273T7712
Database identifiers
- PubChem CID
- 388491
Properties
Computed structural properties
- XLogP
- -2.3
- Topological polar surface area
- 413 Ų
- Hydrogen bond donors
- 12
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 31
- Heavy atoms
- 72
- Formal charge
- 0
- Complexity
- 1,900
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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