In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 1st, 2010 | 27 | Yes |
Popular Name: 2-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-1-[4-(3-fluorobenzoyl)piperazin-1-yl]ethanone 2-(6,7-dihydro-4H-thieno[3,2-c]p…
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) | 1.55 | 9.96 | -53.62 | 1 | 5 | 1 | 45 | 388.488 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.55 | 7.87 | -15.77 | 0 | 5 | 0 | 44 | 387.48 | 3 | ↓ |