In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 14 | Yes |
Popular Name: 3-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]propan-1-amine 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) | 1.24 | 3.09 | -45.59 | 3 | 2 | 1 | 31 | 211.354 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.24 | 4.76 | -33.83 | 3 | 2 | 1 | 30 | 211.354 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.24 | 5.14 | -109.49 | 4 | 2 | 2 | 32 | 212.362 | 3 | ↓ |