In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 20 | Yes |
Popular Name: [2-(4-bromophenyl)sulfanyl-5,6,7,8-tetrahydroquinolin-3-yl]methanamine [2-(4-bromophenyl)sulfanyl-5,6,7…
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) | 4.51 | 8.05 | -46.78 | 3 | 2 | 1 | 41 | 350.305 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.51 | 7.61 | -5.23 | 2 | 2 | 0 | 39 | 349.297 | 3 | ↓ |