In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2004 | 24 | Yes |
Popular Name: (7S)-5-(4-chlorophenyl)-7-(4-ethylphenyl)-6,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (7S)-5-(4-chlorophenyl)-7-(4-eth…
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) | 4.69 | 13.68 | -12.6 | 0 | 4 | 0 | 43 | 336.826 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.69 | 15.01 | -48.87 | 2 | 4 | 1 | 47 | 337.834 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.69 | 14 | -36.77 | 1 | 4 | 1 | 45 | 337.834 | 3 | ↓ |