In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (1R,2R)-2-(aminomethyl)-N-methyl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]cyclohexanamine (1R,2R)-2-(aminomethyl)-N-methyl…
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) | 1.29 | 3.19 | -45.55 | 3 | 3 | 1 | 40 | 227.372 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 5.01 | -109.53 | 4 | 3 | 2 | 41 | 228.38 | 4 | ↓ |