In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 15 | No |
Popular Name: (5R)-5-(bromomethyl)-2-(4-methyl-1,4-diazepan-1-yl)-4,5-dihydrothiazole (5R)-5-(bromomethyl)-2-(4-methyl…
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) | 1.53 | 7.82 | -89.47 | 2 | 3 | 2 | 22 | 294.262 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 5.78 | -28.58 | 1 | 3 | 1 | 20 | 293.254 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.