In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2010 | 18 | No |
Popular Name: (7R)-5,5-dimethyl-2-thiomorpholino-6,7-dihydro-4H-1,3-benzothiazol-7-amine (7R)-5,5-dimethyl-2-thiomorpholi…
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 | 5.88 | -46.96 | 3 | 3 | 1 | 44 | 284.474 | 1 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 5.56 | -5.78 | 2 | 3 | 0 | 42 | 283.466 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.92 | 6.27 | -100.04 | 4 | 3 | 2 | 45 | 285.482 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.