In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 23 | Yes |
Popular Name: 3-(2-oxo-2-piperazin-1-yl-ethyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]triazin-4-one 3-(2-oxo-2-piperazin-1-yl-ethyl)…
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) | 0.49 | 2.93 | -15.63 | 1 | 7 | 0 | 80 | 333.417 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.49 | 4.3 | -58.26 | 2 | 7 | 1 | 85 | 334.425 | 2 | ↓ |