In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 19 | Yes |
Popular Name: (7R)-5,5-dimethyl-2-[(3S)-3-methylmorpholin-4-yl]-6,7-dihydro-4H-1,3-benzothiazol-7-amine (7R)-5,5-dimethyl-2-[(3S)-3-meth…
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) | 0.71 | 4.81 | -45.37 | 3 | 4 | 1 | 53 | 282.433 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.71 | 4.49 | -5.54 | 2 | 4 | 0 | 51 | 281.425 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.71 | 3.92 | -23.08 | 3 | 4 | 1 | 53 | 282.433 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.71 | 4.25 | -99.53 | 4 | 4 | 2 | 54 | 283.441 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.