In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | Yes |
Popular Name: (2S)-2-cyclopropyl-N2-methyl-N2-(4-methylcyclohexyl)propane-1,2-diamine (2S)-2-cyclopropyl-N2-methyl-N2-…
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) | 2.13 | 6.1 | -115.6 | 4 | 2 | 2 | 32 | 226.408 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 4.83 | -39.63 | 3 | 2 | 1 | 31 | 225.4 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.13 | 6.34 | -26.57 | 3 | 2 | 1 | 30 | 225.4 | 4 | ↓ |