In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 21 | Yes |
Popular Name: 1-(aminomethyl)-4-tert-butyl-N-methyl-N-(2-pyridylmethyl)cyclohexanamine 1-(aminomethyl)-4-tert-butyl-N-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) | 2.45 | 7.44 | -122.57 | 4 | 3 | 2 | 45 | 291.483 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.45 | 6.73 | -96.77 | 4 | 3 | 2 | 45 | 291.483 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.45 | 6.04 | -49.57 | 3 | 3 | 1 | 44 | 290.475 | 5 | ↓ |