In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 21 | Yes |
Popular Name: (7R)-N2,5,5-trimethyl-N2-(1-methyl-4-piperidyl)-6,7-dihydro-4H-1,3-benzothiazole-2,7-diamine (7R)-N2,5,5-trimethyl-N2-(1-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) | 0.95 | 7.26 | -87.56 | 4 | 4 | 2 | 48 | 310.511 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.95 | 6.94 | -39.71 | 3 | 4 | 1 | 47 | 309.503 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.95 | 7.59 | -167.28 | 5 | 4 | 3 | 49 | 311.519 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.