In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 17 | Yes |
Popular Name: 7-[[(2S,4R)-4-methoxypyrrolidin-2-yl]methyl]-6,8-dihydro-5H-imidazo[1,2-a]pyrazine 7-[[(2S,4R)-4-methoxypyrrolidin-…
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) | -0.36 | 2.82 | -88.8 | 3 | 5 | 2 | 48 | 238.335 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.36 | 1.02 | -7.96 | 1 | 5 | 0 | 42 | 236.319 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.36 | 1.48 | -28.54 | 2 | 5 | 1 | 44 | 237.327 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.