N~2~-[3-(5-bromo-1H-indol-1-yl)propanoyl]-N~5~-carbamoyl-D-ornithine
Chemical Structure Depiction of
N~2~-[3-(5-bromo-1H-indol-1-yl)propanoyl]-N~5~-carbamoyl-D-ornithine
N~2~-[3-(5-bromo-1H-indol-1-yl)propanoyl]-N~5~-carbamoyl-D-ornithine
Compound characteristics
Compound ID: | Y044-0952 |
Compound Name: | N~2~-[3-(5-bromo-1H-indol-1-yl)propanoyl]-N~5~-carbamoyl-D-ornithine |
Molecular Weight: | 425.28 |
Molecular Formula: | C17 H21 Br N4 O4 |
Smiles: | C(C[C@H](C(O)=O)NC(CCn1ccc2cc(ccc12)[Br])=O)CNC(N)=O |
Stereo: | ABSOLUTE |
logP: | 0.7564 |
logD: | -2.8615 |
logSw: | -1.9043 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 5 |
Polar surface area: | 100.062 |
InChI Key: | WFUONICFBYYZQR-ZDUSSCGKSA-N |