In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 13 | Yes |
Popular Name: (1S,3S)-1-(aminomethyl)-N-ethyl-N,3-dimethyl-cyclohexanamine (1S,3S)-1-(aminomethyl)-N-ethyl-…
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) | 1.51 | 4.93 | -110.26 | 4 | 2 | 2 | 32 | 186.343 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.51 | 3.53 | -44.03 | 3 | 2 | 1 | 31 | 185.335 | 3 | ↓ |