In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 2-[1-[[[2-(isopropylamino)acetyl]amino]methyl]cyclohexyl]acetic 2-[1-[[[2-(isopropylamino)acetyl…
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) | 1.88 | 5.58 | -67.95 | 3 | 5 | 0 | 86 | 270.373 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.88 | 4.37 | -53.5 | 2 | 5 | -1 | 81 | 269.365 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.88 | 3.6 | -41.04 | 4 | 5 | 1 | 83 | 271.381 | 7 | ↓ |