In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2008 | 13 | Yes |
Popular Name: 3-[(5-bromo-2-thienyl)methyl-methyl-amino]propanenitrile 3-[(5-bromo-2-thienyl)methyl-met…
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) | 2.03 | 5.16 | -6.91 | 0 | 2 | 0 | 27 | 259.172 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.03 | 7.56 | -52.9 | 1 | 2 | 1 | 28 | 260.18 | 4 | ↓ |