In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 17 | Yes |
Popular Name: (2R,3R)-2-amino-N-[(4-fluorophenyl)methyl]-3-methyl-pentanamide (2R,3R)-2-amino-N-[(4-fluorophen…
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) | 1.47 | 4.21 | -47.12 | 4 | 3 | 1 | 57 | 239.314 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.47 | 3.88 | -9.18 | 3 | 3 | 0 | 55 | 238.306 | 5 | ↓ |