In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 19 | Yes |
Popular Name: N-[[(1R)-cyclohex-3-en-1-yl]methyl]-1-(4-methoxy-3,5-dimethyl-2-pyridyl)methanamine N-[[(1R)-cyclohex-3-en-1-yl]meth…
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) | 3.33 | 7.22 | -41.45 | 2 | 3 | 1 | 39 | 261.389 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.33 | 5.92 | -4.11 | 1 | 3 | 0 | 34 | 260.381 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.33 | 7.73 | -113.67 | 3 | 3 | 2 | 40 | 262.397 | 5 | ↓ |