In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 17 | Yes |
Popular Name: (2R)-2-amino-N-[(4-bromo-2-thienyl)methyl]-N,2-dimethyl-pentanamide (2R)-2-amino-N-[(4-bromo-2-thien…
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) | 2.98 | 5.33 | -43.87 | 3 | 3 | 1 | 48 | 320.276 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 5.65 | -6.51 | 2 | 3 | 0 | 46 | 319.268 | 5 | ↓ |