In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 15 | Yes |
Popular Name: (2R)-1-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]butan-2-amine (2R)-1-[(4S)-4-methyl-6,7-dihydr…
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) | 1.91 | 4.18 | -45.62 | 3 | 2 | 1 | 31 | 225.381 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 5.92 | -119.88 | 4 | 2 | 2 | 32 | 226.389 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 5.62 | -34.44 | 3 | 2 | 1 | 30 | 225.381 | 3 | ↓ |