In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2008 | 25 | Yes |
Popular Name: (2S)-N-(4-chlorophenyl)-N'-(5-ethyl-1,3,4-thiadiazol-2-yl)pyrrolidine-1,2-dicarboxamide (2S)-N-(4-chlorophenyl)-N'-(5-et…
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 | 6.87 | -26.04 | 2 | 7 | 0 | 87 | 379.873 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.75 | 5.94 | -57.94 | 1 | 7 | -1 | 94 | 378.865 | 4 | ↓ |