In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | No |
Popular Name: 2-[1-[[[(4R)-thiazolidine-4-carbonyl]amino]methyl]cyclohexyl]acetic 2-[1-[[[(4R)-thiazolidine-4-carb…
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) | 1.07 | 4.95 | -61.25 | 3 | 5 | 0 | 86 | 286.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.07 | 3.75 | -50.74 | 2 | 5 | -1 | 81 | 285.389 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.07 | 2.97 | -45.2 | 4 | 5 | 1 | 83 | 287.405 | 5 | ↓ |