In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 20 | Yes |
Popular Name: (1S)-1-(4-chlorophenyl)-3-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)propan-1-amine (1S)-1-(4-chlorophenyl)-3-(6,8-d…
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) | -0.17 | 5.95 | -99.56 | 4 | 4 | 2 | 50 | 292.814 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.17 | 5.65 | -29.51 | 3 | 4 | 1 | 48 | 291.806 | 4 | ↓ |
Hi High (pH 8-9.5) | -0.17 | 5.49 | -60.68 | 3 | 4 | 1 | 49 | 291.806 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.