In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 22nd, 2010 | 17 | Yes |
Popular Name: (2S)-2-(5-bromo-2-thienyl)-2-(cycloheptylamino)ethanol (2S)-2-(5-bromo-2-thienyl)-2-(cy…
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) | 4.29 | 5.27 | -37.8 | 3 | 2 | 1 | 37 | 319.288 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.29 | 4.15 | -3.03 | 2 | 2 | 0 | 32 | 318.28 | 4 | ↓ |