In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 23 | Yes |
Popular Name: (2S)-N'-(5-methyl-1,3,4-thiadiazol-2-yl)-N-phenyl-pyrrolidine-1,2-dicarboxamide (2S)-N'-(5-methyl-1,3,4-thiadiaz…
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) | 1.31 | 5.59 | -27.74 | 2 | 7 | 0 | 87 | 331.401 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.50 | 4.67 | -60.2 | 1 | 7 | -1 | 94 | 330.393 | 3 | ↓ |