In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 20 | Yes |
Popular Name: N-[4-(aminomethyl)-2-(trifluoromethyl)phenyl]-2-methoxy-ethanesulfonamide N-[4-(aminomethyl)-2-(trifluorom…
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) | 1.16 | 0.39 | -63.32 | 3 | 5 | 0 | 85 | 312.313 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.16 | -0.01 | -38.59 | 2 | 5 | -1 | 83 | 311.305 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 0.35 | -57.8 | 4 | 5 | 1 | 83 | 313.321 | 7 | ↓ |