| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 21st, 2010 | 15 | Yes |
Popular Name: (3R)-N1,N3-dimethyl-N1-[(1S,3S)-3-methylcyclohexyl]butane-1,3-diamine (3R)-N1,N3-dimethyl-N1-[(1S,3S)-…
| 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) | 2.64 | 7.45 | -103.52 | 3 | 2 | 2 | 21 | 214.397 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 6.32 | -30.63 | 2 | 2 | 1 | 16 | 213.389 | 5 | ↓ |
| Hi High (pH 8-9.5) | 2.64 | 5.04 | -35.42 | 2 | 2 | 1 | 20 | 213.389 | 5 | ↓ |
