In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 19 | Yes |
Popular Name: 3-(aminomethyl)-N-(2-diethylaminoethyl)benzenesulfonamide 3-(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) | 0.95 | 2.14 | -101.92 | 5 | 5 | 2 | 78 | 287.429 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.95 | -0.17 | -54.84 | 4 | 5 | 1 | 77 | 286.421 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.95 | -0.56 | -9.52 | 3 | 5 | 0 | 75 | 285.413 | 8 | ↓ |