In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 18 | Yes |
Popular Name: (1S,2R,4S)-4-tert-butyl-2-[(2S)-2-methyl-1-piperidyl]cyclohexan-1-amine (1S,2R,4S)-4-tert-butyl-2-[(2S)-…
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) | 3.18 | 7.79 | -116.14 | 4 | 2 | 2 | 32 | 254.462 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.18 | 5.67 | -41.69 | 3 | 2 | 1 | 31 | 253.454 | 2 | ↓ |