In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 20 | Yes |
Popular Name: (2R)-2-amino-N-[(4-chlorophenyl)methyl]-N-cyclopropyl-butanediamide (2R)-2-amino-N-[(4-chlorophenyl)…
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) | 1.19 | 2.1 | -42.05 | 5 | 5 | 1 | 91 | 296.778 | 6 | ↓ |
Hi High (pH 8-9.5) | 1.19 | 1.78 | -9.83 | 4 | 5 | 0 | 89 | 295.77 | 6 | ↓ |