In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 15 | Yes |
Popular Name: (2R)-2-[(3-bromo-2-thienyl)methyl-methyl-amino]butanoic (2R)-2-[(3-bromo-2-thienyl)methy…
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) | 1.03 | 7.83 | -29.75 | 1 | 3 | 0 | 45 | 292.198 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.03 | 5.34 | -45.67 | 0 | 3 | -1 | 43 | 291.19 | 5 | ↓ |