In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 16 | No |
Popular Name: (5S)-5-(bromomethyl)-2-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-yl)-4,5-dihydrothiazole (5S)-5-(bromomethyl)-2-(6,8-dihy…
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) | 0.79 | 7.22 | -88.64 | 2 | 4 | 2 | 36 | 303.229 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.79 | 5.9 | -9.45 | 0 | 4 | 0 | 33 | 301.213 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.79 | 6.75 | -36.75 | 1 | 4 | 1 | 35 | 302.221 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.