In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 24th, 2011 | 30 | Yes |
Popular Name: N-(3,4-dimethylisoxazol-5-yl)-4-(BLAHylamino)benzenesulfonamide N-(3,4-dimethylisoxazol-5-yl)-4-…
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) | 4.04 | 7.1 | -52.89 | 1 | 8 | -1 | 112 | 440.53 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.04 | 7.75 | -18.26 | 2 | 8 | 0 | 110 | 441.538 | 5 | ↓ |