In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 17 | Yes |
Popular Name: [2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-3-pyridyl]methanamine [2-(6,7-dihydro-4H-thieno[3,2-c]…
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) | 1.54 | 5.68 | -51.78 | 3 | 3 | 1 | 44 | 246.359 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.54 | 5.36 | -6.1 | 2 | 3 | 0 | 42 | 245.351 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 6.15 | -108.68 | 4 | 3 | 2 | 45 | 247.367 | 2 | ↓ |