In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2009 | 33 | Yes |
Popular Name: 2-[butyl(ethyl)amino]ethyl-methyl-N-(4-methylcyclohexyl)-oxo-BLAHcarboxamide 2-[butyl(ethyl)amino]ethyl-methy…
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) | 3.95 | 12.81 | -44.23 | 2 | 7 | 1 | 72 | 457.639 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.95 | 10.62 | -11.5 | 1 | 7 | 0 | 71 | 456.631 | 9 | ↓ |