In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2011 | 14 | Yes |
Popular Name: 2-[(1S,2S)-2-(aminomethyl)-1-ethyl-cyclohexyl]acetic 2-[(1S,2S)-2-(aminomethyl)-1-eth…
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) | 1.37 | 4.34 | -75.74 | 3 | 3 | 0 | 68 | 199.294 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.37 | 2.36 | -52.94 | 4 | 3 | 1 | 65 | 200.302 | 4 | ↓ |