In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 7th, 2004 | 26 | No |
Popular Name: (7S)-5-(4-iodophenyl)-7-(1-naphthyl)-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine (7S)-5-(4-iodophenyl)-7-(1-napht…
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) | 5.34 | 14.86 | -12.71 | 0 | 4 | 0 | 43 | 450.283 | 2 | ↓ |
Mid Mid (pH 6-8) | 5.34 | 16.43 | -48.54 | 2 | 4 | 1 | 47 | 451.291 | 2 | ↓ |
Lo Low (pH 4.5-6) | 5.34 | 15.38 | -33.53 | 1 | 4 | 1 | 44 | 451.291 | 2 | ↓ |