In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (1R,2S)-1-(aminomethyl)-N,2-dimethyl-N-[[(2S)-tetrahydropyran-2-yl]methyl]cyclohexanamine (1R,2S)-1-(aminomethyl)-N,2-dime…
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) | 2.24 | 4.37 | -41.53 | 3 | 3 | 1 | 40 | 255.426 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.24 | 6.05 | -26.34 | 3 | 3 | 1 | 40 | 255.426 | 4 | ↓ |