In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: N'-[(4S)-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-yl]-N,N-diethyl-ethane-1,2-diamine N'-[(4S)-1,1-dioxo-3,4-dihydro-2…
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) | 0.95 | 4.78 | -51.7 | 2 | 4 | 1 | 51 | 297.444 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.95 | 2.62 | -11.54 | 1 | 4 | 0 | 49 | 296.436 | 6 | ↓ |