| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 12th, 2008 | 30 | Yes |
Popular Name: (S)-2-(Butylsulfonamido)-3-(4-(4-(pyridin-4-yl)butoxy)phenyl)propanoic acid (S)-2-(Butylsulfonamido)-3-(4-(4…
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CAS Numbers: 149490-61-9 , [149490-61-9]
N-(Butylsulfonyl)-O-[4-(4-pyridinyl)butyl]-L-tyrosine
N-(Butylsulfonyl)-O-[4-pyridin-4-yl]butyl]-L-tyrosine
N-(n-Butanesulfonyl)-O-[4-(4-pyridinyl)-butyl]-(S)-tyrosine
N-Butylsulfonyl-O-(4-(4-pyridinyl)butyl)-L-tyrosin
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.85 | 8.32 | -46.56 | 1 | 7 | -1 | 108 | 433.55 | 14 | ↓ |
| Lo Low (pH 4.5-6) | 1.85 | 8.76 | -68.46 | 2 | 7 | 0 | 110 | 434.558 | 14 | ↓ |
No pre-computed analogs available. Try a structural similarity search.