In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2010 | 14 | Yes |
Popular Name: 3-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]propan-1-ol 3-[(4S)-4-methyl-6,7-dihydro-4H-…
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) | 1.81 | 4.43 | -35.64 | 2 | 2 | 1 | 25 | 212.338 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.81 | 2.39 | -4.85 | 1 | 2 | 0 | 23 | 211.33 | 3 | ↓ |