In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2010 | 24 | Yes |
Popular Name: N-(2-dimethylaminoethyl)-N-[(4-fluorophenyl)methyl]-3,5-dimethyl-isoxazole-4-sulfonamide N-(2-dimethylaminoethyl)-N-[(4-f…
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) | 1.70 | 7.19 | -55.91 | 1 | 6 | 1 | 68 | 356.443 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.70 | 4.54 | -12.01 | 0 | 6 | 0 | 67 | 355.435 | 7 | ↓ |