In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: (2R,3S)-2-amino-N-[(1R)-1-(2-bromophenyl)ethyl]-3-methyl-N-propyl-pentanamide (2R,3S)-2-amino-N-[(1R)-1-(2-bro…
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) | 3.75 | 8.4 | -43.39 | 3 | 3 | 1 | 48 | 356.328 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.75 | 8.12 | -6.23 | 2 | 3 | 0 | 46 | 355.32 | 7 | ↓ |