In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 32 | No |
Popular Name: (4-methyl-3-nitro-phenyl)-[4-[6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]methanone (4-methyl-3-nitro-phenyl)-[4-[6-…
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) | 4.03 | 13.68 | -17.35 | 0 | 8 | 0 | 95 | 431.496 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.03 | 14 | -41.65 | 1 | 8 | 1 | 96 | 432.504 | 4 | ↓ |