In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 19 | Yes |
Popular Name: 2-methoxy-N-[5-(2-pyrrolidin-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide 2-methoxy-N-[5-(2-pyrrolidin-1-y…
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) | 0.97 | 5.68 | -48.62 | 2 | 6 | 1 | 69 | 303.433 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.16 | 3.05 | -61.39 | 1 | 6 | 0 | 75 | 302.425 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.16 | 0.59 | -45.85 | 0 | 6 | -1 | 74 | 301.417 | 7 | ↓ |