In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 15 | Yes |
Popular Name: 1-[[ethyl-[(1S)-1-methylpropyl]amino]methyl]cyclohexanamine 1-[[ethyl-[(1S)-1-methylpropyl]a…
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) | 3.31 | 6.21 | -107.92 | 4 | 2 | 2 | 32 | 214.397 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.31 | 4.44 | -37.14 | 3 | 2 | 1 | 31 | 213.389 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.31 | 6.4 | -28.13 | 3 | 2 | 1 | 30 | 213.389 | 5 | ↓ |