In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2009 | 36 | Yes |
Popular Name: N-cyclohexyl-dimethyl-oxo-[3-(4-propylpiperazin-1-yl)propyl]BLAHcarboxamide N-cyclohexyl-dimethyl-oxo-[3-(4-…
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) | 3.62 | 11.71 | -47.37 | 2 | 8 | 1 | 75 | 498.692 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 9.33 | -12.22 | 1 | 8 | 0 | 74 | 497.684 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 11.62 | -50.57 | 2 | 8 | 1 | 75 | 498.692 | 8 | ↓ |