In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2004 | 26 | Yes |
Popular Name: (5R,7R)-7-(1-naphthyl)-5-(p-tolyl)-4,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidine (5R,7R)-7-(1-naphthyl)-5-(p-toly…
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) | 4.54 | 13.23 | -11.2 | 1 | 4 | 0 | 43 | 340.43 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.72 | 14.74 | -118.4 | 3 | 4 | 2 | 49 | 342.446 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.72 | 13.82 | -44.9 | 2 | 4 | 1 | 47 | 341.438 | 2 | ↓ |