In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 10th, 2009 | 21 | Yes |
Popular Name: 2-[4-[(5-oxo-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-yl)methyl]piperazin-1-yl]acetic 2-[4-[(5-oxo-[1,3,4]thiadiazolo[…
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) | -1.28 | 3.92 | -43.52 | 1 | 8 | 0 | 95 | 309.351 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.28 | 4.04 | -66.97 | 1 | 8 | 0 | 95 | 309.351 | 4 | ↓ |
Mid Mid (pH 6-8) | -1.28 | 1.74 | -56.48 | 0 | 8 | -1 | 94 | 308.343 | 4 | ↓ |