In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 19 | Yes |
Popular Name: 4-(aminomethyl)-N-(2-diethylaminoethyl)benzenesulfonamide 4-(aminomethyl)-N-(2-diethylamin…
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) | 0.97 | 2.15 | -104.85 | 5 | 5 | 2 | 78 | 287.429 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.97 | -0.55 | -9.96 | 3 | 5 | 0 | 75 | 285.413 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.97 | -0.16 | -56.8 | 4 | 5 | 1 | 77 | 286.421 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.97 | 1.75 | -45.61 | 4 | 5 | 1 | 77 | 286.421 | 8 | ↓ |