In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2010 | 18 | Yes |
Popular Name: N-[2-(1,1-dioxobenzo[e][1,2,4]thiadiazin-2-yl)ethyl]prop-2-en-1-amine N-[2-(1,1-dioxobenzo[e][1,2,4]th…
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) | 1.07 | 4.19 | -53.31 | 2 | 5 | 1 | 66 | 266.346 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.07 | 2.82 | -12.02 | 1 | 5 | 0 | 62 | 265.338 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.