In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2010 | 21 | Yes |
Popular Name: N-[2-(1,1-dioxobenzo[e][1,2,4]thiadiazin-2-yl)ethyl]-4-methyl-pentan-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) | 2.35 | 6.45 | -55.46 | 2 | 5 | 1 | 66 | 310.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.35 | 5.1 | -11.9 | 1 | 5 | 0 | 62 | 309.435 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.