In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (1S,2S)-1-(aminomethyl)-N-isopropyl-2-methyl-N-propyl-cyclohexanamine (1S,2S)-1-(aminomethyl)-N-isopro…
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) | 2.92 | 6.33 | -107.97 | 4 | 2 | 2 | 32 | 228.424 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.92 | 4.47 | -41.4 | 3 | 2 | 1 | 31 | 227.416 | 5 | ↓ |