In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: (2S)-2-amino-N-cyclopropyl-N-[(4-fluorophenyl)methyl]-4-methyl-pentanamide (2S)-2-amino-N-cyclopropyl-N-[(4…
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) | 2.11 | 6.61 | -41.32 | 3 | 3 | 1 | 48 | 279.379 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 6.34 | -7.39 | 2 | 3 | 0 | 46 | 278.371 | 6 | ↓ |