In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 16 | Yes |
Popular Name: (1S,2S)-2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)cyclopentanecarbonitrile (1S,2S)-2-(6,7-dihydro-4H-thieno…
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) | 2.66 | 8.68 | -44.89 | 1 | 2 | 1 | 28 | 233.36 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.66 | 6.59 | -6.01 | 0 | 2 | 0 | 27 | 232.352 | 1 | ↓ |