In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 23rd, 2007 | 26 | Yes |
Popular Name: 3,4,5-triethoxy-N-(5-isopropyl-3H-1,3,4-thiadiazol-2-ylidene)-benzamide 3,4,5-triethoxy-N-(5-isopropyl-3…
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) | 3.08 | 8.23 | -18.52 | 1 | 7 | 0 | 83 | 379.482 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.14 | 7.31 | -45.82 | 0 | 7 | -1 | 89 | 378.474 | 9 | ↓ |