In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 17th, 2008 | 29 | No |
Popular Name: 2-[4-(furan-2-carbonyl)piperazin-1-yl]-N-[5-(m-tolyl)-1,3,4-thiadiazol-2-yl]acetamide 2-[4-(furan-2-carbonyl)piperazin…
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) | 2.57 | 7.53 | -41.62 | 1 | 8 | 0 | 99 | 411.487 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.57 | 5.32 | -47.89 | 0 | 8 | -1 | 98 | 410.479 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.76 | 6.41 | -24.56 | 1 | 8 | 0 | 92 | 411.487 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.75 | 8.56 | -60.97 | 2 | 8 | 1 | 93 | 412.495 | 5 | ↓ |