In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2009 | 19 | Yes |
Popular Name: 2-[5-[[(2S)-2-(dimethylamino)propyl]sulfamoyl]-2-thienyl]acetic 2-[5-[[(2S)-2-(dimethylamino)pro…
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) | 0.98 | 3.88 | -70.42 | 2 | 6 | 0 | 91 | 306.409 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 1.82 | -46.31 | 1 | 6 | -1 | 90 | 305.401 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 3.49 | -75.99 | 1 | 6 | -1 | 93 | 305.401 | 7 | ↓ |