In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 21 | Yes |
Popular Name: (1R,2S)-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-(p-tolyl)butan-2-amine (1R,2S)-1-(6,7-dihydro-4H-thieno…
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) | 3.38 | 8.25 | -39.79 | 3 | 2 | 1 | 31 | 301.479 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.38 | 9.86 | -123.6 | 4 | 2 | 2 | 32 | 302.487 | 4 | ↓ |