In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 17 | Yes |
Popular Name: 2-(tert-butylamino)-1-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)ethanone 2-(tert-butylamino)-1-(6,7-dihyd…
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) | 1.90 | 6.14 | -38.68 | 2 | 3 | 1 | 37 | 253.391 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.90 | 4.92 | -7.56 | 1 | 3 | 0 | 32 | 252.383 | 3 | ↓ |