In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: [(4S)-4-cyclopropyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl]-[(2R)-2-piperidyl]methanone [(4S)-4-cyclopropyl-6,7-dihydro-…
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 | 7.88 | -40.24 | 2 | 3 | 1 | 37 | 291.44 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.66 | 6.62 | -8.62 | 1 | 3 | 0 | 32 | 290.432 | 2 | ↓ |