In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 17 | Yes |
Popular Name: 9-[(1R)-1-(aminomethyl)-2,2,2-trifluoro-ethyl]purin-6-amine 9-[(1R)-1-(aminomethyl)-2,2,2-tr…
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) | 0.02 | 2.61 | -53.43 | 5 | 6 | 1 | 97 | 247.204 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.02 | 2.1 | -8.5 | 4 | 6 | 0 | 96 | 246.196 | 3 | ↓ |