In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 16 | Yes |
Popular Name: N-isobutyl-2-[[(1S,3R)-3-methylcyclohexyl]amino]acetamide N-isobutyl-2-[[(1S,3R)-3-methylc…
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) | 2.74 | 5.31 | -39.95 | 3 | 3 | 1 | 46 | 227.372 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.74 | 4.13 | -6.42 | 2 | 3 | 0 | 41 | 226.364 | 5 | ↓ |