In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: (1S,3R)-1-(aminomethyl)-N-[(1S)-1-cyclopropylethyl]-N,3-dimethyl-cyclohexanamine (1S,3R)-1-(aminomethyl)-N-[(1S)-…
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) | 2.33 | 6.48 | -111.54 | 4 | 2 | 2 | 32 | 226.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.33 | 4.75 | -41.02 | 3 | 2 | 1 | 31 | 225.4 | 4 | ↓ |