In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 21st, 2011 | 20 | No |
Popular Name: (2S)-1-(4-nitro-1,3-benzothiazol-5-yl)pyrrolidine-2-carboxylic (2S)-1-(4-nitro-1,3-benzothiazol…
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) | 0.52 | 7.58 | -52.56 | 0 | 7 | -1 | 102 | 292.296 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.52 | 7.87 | -51.14 | 1 | 7 | 0 | 103 | 293.304 | 3 | ↓ |