In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 24th, 2009 | 31 | No |
Popular Name: 6-(4-benzylpiperazin-1-yl)-N-(2-cyclohexen-1-ylethyl)-5-nitro-pyrimidin-4-amine 6-(4-benzylpiperazin-1-yl)-N-(2-…
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) | 3.99 | 15.09 | -39.52 | 2 | 8 | 1 | 91 | 423.541 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.99 | 12.89 | -6.15 | 1 | 8 | 0 | 90 | 422.533 | 8 | ↓ |