| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| March 10th, 2008 | 22 | Yes |
Popular Name: (2S)-2-(4-tert-butylphenyl)sulfonyl-2-(3-pyridyl)ethanamine (2S)-2-(4-tert-butylphenyl)sulfo…
| 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) | 1.66 | -4.81 | -58.43 | 3 | 4 | 1 | 75 | 319.45 | 5 | ↓ |
| Lo Low (pH 4.5-6) | 1.66 | -4.7 | -118.14 | 4 | 4 | 2 | 76 | 320.458 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
