In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 21 | Yes |
Popular Name: (3S)-1-[[(1S)-2-(diethylamino)-1-methyl-ethyl]sulfamoyl]piperidine-3-carboxylic (3S)-1-[[(1S)-2-(diethylamino)-1…
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) | 0.61 | 4.56 | -80.22 | 1 | 7 | -1 | 96 | 320.435 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.61 | 2.53 | -47.44 | 1 | 7 | -1 | 93 | 320.435 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.61 | 4.39 | -65.17 | 2 | 7 | 0 | 94 | 321.443 | 8 | ↓ |