In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 18 | Yes |
Popular Name: (2R)-2-(cyclopropylamino)-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)propanoic (2R)-2-(cyclopropylamino)-3-(6,8…
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) | -2.31 | 6.97 | -82.93 | 3 | 6 | 1 | 79 | 251.31 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.31 | 4.72 | -56.91 | 2 | 6 | 0 | 74 | 250.302 | 5 | ↓ |
Hi High (pH 8-9.5) | -2.31 | 5.1 | -32.35 | 2 | 6 | 0 | 78 | 250.302 | 5 | ↓ |
Mid Mid (pH 6-8) | -2.31 | 5.57 | -64.11 | 3 | 6 | 1 | 79 | 251.31 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.