In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 29th, 2009 | 25 | Yes |
Popular Name: (2S)-N2-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-N1-ethyl-pyrrolidine-1,2-dicarboxamide (2S)-N2-[5-(4-bromophenyl)-1,3,4…
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) | 3.56 | 6.53 | -23.86 | 2 | 7 | 0 | 87 | 424.324 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.74 | 5.51 | -57.69 | 1 | 7 | -1 | 94 | 423.316 | 4 | ↓ |