In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 26 | Yes |
Popular Name: N-[5-(2-pyrrolidin-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]adamantane-1-carboxamide N-[5-(2-pyrrolidin-1-ylethylsulf…
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) | 3.92 | 10.57 | -44.29 | 2 | 5 | 1 | 59 | 393.602 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.92 | 8.1 | -13.01 | 1 | 5 | 0 | 58 | 392.594 | 6 | ↓ |