In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 28 | Yes |
Popular Name: 4-chloro-2-[(2S,4S)-2-(4-chlorophenyl)-6-(p-tolyl)-1,2,3,4-tetrahydropyrimidin-4-yl]phenol 4-chloro-2-[(2S,4S)-2-(4-chlorop…
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) | 5.73 | 9.46 | -5.91 | 2 | 3 | 0 | 45 | 411.332 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.73 | 10.21 | -38.69 | 1 | 3 | -1 | 47 | 410.324 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.