In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | Yes |
Popular Name: (3R)-3-[(4S)-4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]pentanenitrile (3R)-3-[(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) | 2.49 | 6.63 | -8.59 | 0 | 2 | 0 | 27 | 234.368 | 3 | ↓ |
Mid Mid (pH 6-8) | 2.49 | 8.22 | -41.4 | 1 | 2 | 1 | 28 | 235.376 | 3 | ↓ |