In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 23rd, 2009 | 17 | Yes |
Popular Name: (2R)-2-amino-N-[(4-fluorophenyl)methyl]-N,3-dimethyl-butanamide (2R)-2-amino-N-[(4-fluorophenyl)…
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) | 1.21 | 4.97 | -45.36 | 3 | 3 | 1 | 48 | 239.314 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.21 | 4.68 | -7.69 | 2 | 3 | 0 | 46 | 238.306 | 4 | ↓ |