In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2011 | 21 | Yes |
Popular Name: (2S)-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-2-(methylamino)-2-phenyl-propan-1-ol (2S)-3-(6,8-dihydro-5H-imidazo[1…
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) | 0.57 | 5.6 | -90.61 | 4 | 5 | 2 | 59 | 288.395 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.57 | 5.14 | -44.7 | 3 | 5 | 1 | 58 | 287.387 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.57 | 4.44 | -28.96 | 3 | 5 | 1 | 55 | 287.387 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.