In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 21 | Yes |
Popular Name: 2-[1-[[3-(tert-butylamino)propanoylamino]methyl]cyclohexyl]acetic 2-[1-[[3-(tert-butylamino)propan…
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) | 2.17 | 6.57 | -73.89 | 3 | 5 | 0 | 86 | 298.427 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 4.59 | -43.77 | 4 | 5 | 1 | 83 | 299.435 | 8 | ↓ |