In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 20 | Yes |
Popular Name: (4R)-N-[[(1R)-cyclohex-3-en-1-yl]methyl]-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-amine (4R)-N-[[(1R)-cyclohex-3-en-1-yl…
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) | 1.97 | 6.2 | -64.59 | 2 | 3 | 1 | 51 | 292.424 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.97 | 5.46 | -12.17 | 1 | 3 | 0 | 46 | 291.416 | 3 | ↓ |