In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 19 | Yes |
Popular Name: (1S,2R,4R)-2-(azocan-1-yl)-4-tert-butyl-cyclohexanamine (1S,2R,4R)-2-(azocan-1-yl)-4-ter…
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) | 3.86 | 8.54 | -118.73 | 4 | 2 | 2 | 32 | 268.489 | 2 | ↓ |
Hi High (pH 8-9.5) | 3.86 | 8.29 | -30.06 | 3 | 2 | 1 | 30 | 267.481 | 2 | ↓ |