In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2004 | 24 | Yes |
Popular Name: (7S)-7-(2,4-dichlorophenyl)-5-(4-fluorophenyl)-6,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (7S)-7-(2,4-dichlorophenyl)-5-(4…
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 | 12.68 | -11 | 0 | 4 | 0 | 43 | 361.207 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.55 | 14.2 | -50.07 | 2 | 4 | 1 | 47 | 362.215 | 2 | ↓ |
Mid Mid (pH 6-8) | 4.55 | 13.01 | -38.74 | 1 | 4 | 1 | 45 | 362.215 | 2 | ↓ |