In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2011 | 18 | Yes |
Popular Name: [3-chloro-4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)phenyl]methanamine [3-chloro-4-(6,8-dihydro-5H-imid…
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) | 1.25 | 6.53 | -84.56 | 4 | 4 | 2 | 50 | 264.76 | 2 | ↓ |
Hi High (pH 8-9.5) | 1.25 | 5.66 | -7.04 | 2 | 4 | 0 | 47 | 262.744 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.25 | 6.06 | -53.93 | 3 | 4 | 1 | 49 | 263.752 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.