In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 16 | Yes |
Popular Name: (1S,2R,4S)-N2-[(1S)-1-cyclopropylethyl]-N1,N2,4-trimethyl-cyclohexane-1,2-diamine (1S,2R,4S)-N2-[(1S)-1-cyclopropy…
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) | 2.72 | 7.28 | -109.36 | 3 | 2 | 2 | 21 | 226.408 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 6.65 | -34.42 | 2 | 2 | 1 | 20 | 225.4 | 4 | ↓ |