In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2008 | 21 | Yes |
Popular Name: 1-[2-(aminomethyl)phenyl]-N-(2,5-dimethylphenyl)methanesulfonamide 1-[2-(aminomethyl)phenyl]-N-(2,5…
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) | 2.73 | 4.65 | -53.58 | 4 | 4 | 1 | 74 | 305.423 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 4.73 | -55.79 | 3 | 4 | 0 | 76 | 304.415 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.73 | 4.27 | -11.15 | 3 | 4 | 0 | 72 | 304.415 | 5 | ↓ |