In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (1S,2R,4R)-4-tert-butyl-2-[(2S)-2-ethylpyrrolidin-1-yl]-N-methyl-cyclohexanamine (1S,2R,4R)-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) | 4.12 | 8.52 | -29.43 | 2 | 2 | 1 | 16 | 267.481 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.12 | 7.72 | -33.91 | 2 | 2 | 1 | 20 | 267.481 | 4 | ↓ |