In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2004 | 25 | Yes |
1766-91-2; D01241; Penflutizide (JAN/INN)
3-Pentyl-6-(trifluoromethyl)-3,4-dihydro-2H-benzo[e][1,2,4]thiadiazine-7-sulfonamide 1,1-dioxide
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) | 2.59 | -1.03 | -19.95 | 4 | 7 | 0 | 118 | 401.432 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.59 | -1.6 | -43.14 | 3 | 7 | -1 | 120 | 400.424 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.