In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 11th, 2012 | 40 | No |
Popular Name: N-[(1R,2R)-1-benzyl-3-(cyclohexylamino)-2-hydroxy-propyl]-diethyl-dioxo-BLAHcarboxamide N-[(1R,2R)-1-benzyl-3-(cyclohexy…
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) | 4.72 | 10.25 | -66.01 | 4 | 8 | 1 | 108 | 567.776 | 10 | ↓ |
Hi High (pH 8-9.5) | 4.72 | 9.07 | -20.77 | 3 | 8 | 0 | 104 | 566.768 | 10 | ↓ |