In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2004 | 24 | Yes |
Popular Name: (7S)-7-(3-bromophenyl)-5-(4-methoxyphenyl)-6,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (7S)-7-(3-bromophenyl)-5-(4-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) | 3.94 | 11.61 | -12.58 | 0 | 5 | 0 | 52 | 383.249 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.94 | 12.13 | -32.83 | 1 | 5 | 1 | 54 | 384.257 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.94 | 11.94 | -37.02 | 1 | 5 | 1 | 54 | 384.257 | 3 | ↓ |