In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 20 | Yes |
Popular Name: [4-tert-butyl-1-[(3S)-3-ethyl-1-piperidyl]cyclohexyl]methanamine [4-tert-butyl-1-[(3S)-3-ethyl-1-…
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) | 3.87 | 9.02 | -120.26 | 4 | 2 | 2 | 32 | 282.516 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.87 | 7.38 | -43.83 | 3 | 2 | 1 | 31 | 281.508 | 4 | ↓ |