In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 19 | Yes |
Popular Name: (1S,2R)-2-tert-butyl-N-[(1R)-1-(3-pyridyl)ethyl]cyclohexan-1-amine (1S,2R)-2-tert-butyl-N-[(1R)-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) | 4.29 | 8.68 | -34.13 | 2 | 2 | 1 | 29 | 261.433 | 4 | ↓ |
Lo Low (pH 4.5-6) | 4.29 | 9.12 | -100.5 | 3 | 2 | 2 | 31 | 262.441 | 4 | ↓ |