In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 13th, 2010 | 19 | Yes |
Popular Name: N-ethyl-N-methyl-N'-[(5-phenyl-2-thienyl)methyl]ethane-1,2-diamine N-ethyl-N-methyl-N'-[(5-phenyl-2…
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) | 3.72 | 8.72 | -35.55 | 2 | 2 | 1 | 16 | 275.441 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.72 | 6.39 | -3.51 | 1 | 2 | 0 | 15 | 274.433 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.72 | 10.06 | -117.27 | 3 | 2 | 2 | 21 | 276.449 | 7 | ↓ |