In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 2-[1-[[[(2R)-2-aminopentanoyl]amino]methyl]cyclohexyl]acetic 2-[1-[[[(2R)-2-aminopentanoyl]am…
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) | 1.23 | 4.43 | -73.46 | 4 | 5 | 0 | 97 | 270.373 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.23 | 4.14 | -51.21 | 3 | 5 | -1 | 95 | 269.365 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.23 | 2.44 | -46.12 | 5 | 5 | 1 | 94 | 271.381 | 7 | ↓ |