In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 18 | Yes |
Popular Name: (1S,2S,4R)-N2-(2-dimethylaminoethyl)-N1,4-dimethyl-N2-propyl-cyclohexane-1,2-diamine (1S,2S,4R)-N2-(2-dimethylaminoet…
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) | 2.43 | 6.77 | -95.61 | 3 | 3 | 2 | 24 | 257.466 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.43 | 4.3 | -35.24 | 2 | 3 | 1 | 23 | 256.458 | 7 | ↓ |