In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2009 | 20 | Yes |
Popular Name: 2-[[3-(2-dimethylaminoethyloxy)phenyl]sulfamoyl]acetic 2-[[3-(2-dimethylaminoethyloxy)p…
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) | 0.48 | 3.76 | -74.16 | 2 | 7 | 0 | 100 | 302.352 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 1.29 | -50.34 | 1 | 7 | -1 | 99 | 301.344 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 1.32 | -113.51 | 0 | 7 | -2 | 101 | 300.336 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.48 | 3.79 | -121.31 | 1 | 7 | -1 | 102 | 301.344 | 8 | ↓ |