In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 14 | Yes |
Popular Name: (2R)-N2-methyl-N2-(4-methylcyclohexyl)butane-1,2-diamine (2R)-N2-methyl-N2-(4-methylcyclo…
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) | 1.69 | 5.65 | -116.24 | 4 | 2 | 2 | 32 | 200.37 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 3.9 | -41.95 | 3 | 2 | 1 | 31 | 199.362 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.69 | 5.69 | -27.39 | 3 | 2 | 1 | 30 | 199.362 | 4 | ↓ |