In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2008 | 21 | Yes |
Popular Name: 1-(5-bromo-2-thienyl)-N-[[1-(1-piperidyl)cyclohexyl]methyl]methanamine 1-(5-bromo-2-thienyl)-N-[[1-(1-p…
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) | 5.24 | 9.89 | -35.06 | 2 | 2 | 1 | 16 | 372.396 | 5 | ↓ |
Hi High (pH 8-9.5) | 5.24 | 7.42 | -1.71 | 1 | 2 | 0 | 15 | 371.388 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.24 | 11.1 | -117.79 | 3 | 2 | 2 | 21 | 373.404 | 5 | ↓ |
Mid Mid (pH 6-8) | 5.24 | 8.95 | -40.05 | 2 | 2 | 1 | 20 | 372.396 | 5 | ↓ |