In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 19 | Yes |
Popular Name: (1S,2S)-N-[(1R)-1-(4-bromophenyl)propyl]-2-methoxy-cyclohexanamine (1S,2S)-N-[(1R)-1-(4-bromophenyl…
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) | 3.84 | 8.75 | -36.91 | 2 | 2 | 1 | 26 | 327.286 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.84 | 7.89 | -2.82 | 1 | 2 | 0 | 21 | 326.278 | 5 | ↓ |