In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: (2R)-2-amino-1-[(4R)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]butan-1-one (2R)-2-amino-1-[(4R)-4-ethyl-6,7…
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) | 1.73 | 5.21 | -45.69 | 3 | 3 | 1 | 48 | 253.391 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.73 | 4.87 | -8.58 | 2 | 3 | 0 | 46 | 252.383 | 3 | ↓ |