| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 11th, 2010 | 21 | Yes |
Popular Name: (6S)-N6-[4-(trifluoromethyl)phenyl]-6H-purine-2,6-diamine (6S)-N6-[4-(trifluoromethyl)phen…
| 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) | 1.80 | 4.86 | -13.97 | 3 | 6 | 0 | 88 | 294.24 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.80 | 4.86 | -35.86 | 4 | 6 | 1 | 90 | 295.248 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 1.93 | 4.9 | -39.71 | 4 | 6 | 1 | 88 | 295.248 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
