In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 12th, 2010 | 19 | Yes |
Popular Name: 3-[(4S)-4-ethyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-N-isopropyl-propanamide 3-[(4S)-4-ethyl-6,7-dihydro-4H-t…
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) | 2.72 | 7.66 | -39.87 | 2 | 3 | 1 | 34 | 281.445 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 6.04 | -7.93 | 1 | 3 | 0 | 32 | 280.437 | 5 | ↓ |