In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 16 | No |
Popular Name: (5R)-5-(bromomethyl)-N-methyl-N-[(1-methylimidazol-2-yl)methyl]-4,5-dihydrothiazol-2-amine (5R)-5-(bromomethyl)-N-methyl-N-…
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) | 0.92 | 7.39 | -84.57 | 2 | 4 | 2 | 36 | 305.245 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 6.09 | -12.3 | 0 | 4 | 0 | 33 | 303.229 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.92 | 7.03 | -33.7 | 1 | 4 | 1 | 35 | 304.237 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.