In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 24 | Yes |
Popular Name: (7S)-5-(3-methoxyphenyl)-7-(p-tolyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (7S)-5-(3-methoxyphenyl)-7-(p-to…
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) | 3.41 | 12.35 | -9.99 | 1 | 5 | 0 | 52 | 318.38 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.58 | 12.02 | -34.45 | 1 | 5 | 1 | 54 | 319.388 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.58 | 12.21 | -31.56 | 1 | 5 | 1 | 54 | 319.388 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.