In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 17 | Yes |
Popular Name: N',N'-diisopropyl-N-[(1R,2S)-2-methylcyclohexyl]ethane-1,2-diamine N',N'-diisopropyl-N-[(1R,2S)-2-m…
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) | 3.62 | 6.59 | -37.67 | 2 | 2 | 1 | 20 | 241.443 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 7.34 | -28.49 | 2 | 2 | 1 | 16 | 241.443 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.62 | 8.65 | -110.63 | 3 | 2 | 2 | 21 | 242.451 | 6 | ↓ |