In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 31st, 2011 | 28 | Yes |
Popular Name: 4-bromo-2-[(2S,6R)-4-(4-ethylphenyl)-2-(3-pyridyl)-1,2,5,6-tetrahydropyrimidin-6-yl]phenol 4-bromo-2-[(2S,6R)-4-(4-ethylphe…
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) | 4.41 | 8.1 | -7.1 | 2 | 4 | 0 | 58 | 436.353 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.41 | 8.86 | -40.57 | 1 | 4 | -1 | 60 | 435.345 | 4 | ↓ |