In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 19th, 2011 | 21 | No |
Popular Name: (4S)-N-[(3S)-1,1-dioxothian-3-yl]-1,1-dioxo-3,4-dihydro-2H-thiochromen-4-amine (4S)-N-[(3S)-1,1-dioxothian-3-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) | -0.04 | 0.28 | -23.26 | 1 | 5 | 0 | 80 | 329.443 | 2 | ↓ |
Mid Mid (pH 6-8) | -0.04 | 1.39 | -78.38 | 2 | 5 | 1 | 85 | 330.451 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.