| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 2nd, 2011 | 26 | No |
Popular Name: 4-[(1R)-1-[(Z)-(2-hydroxy-1-naphthyl)methyleneamino]ethyl]-N-methyl-benzenesulfonamide 4-[(1R)-1-[(Z)-(2-hydroxy-1-naph…
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| 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) | 3.90 | 4.66 | -45.62 | 3 | 5 | 1 | 80 | 369.466 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.90 | 5.35 | -53.25 | 1 | 5 | -1 | 82 | 367.45 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.90 | 4.57 | -12.68 | 2 | 5 | 0 | 79 | 368.458 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.90 | 3.75 | -12.2 | 2 | 5 | 0 | 79 | 368.458 | 5 | ↓ |
| Hi High (pH 8-9.5) | 3.90 | 4.53 | -45.18 | 1 | 5 | -1 | 82 | 367.45 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
