In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (2R)-2-amino-N-(2-cyanoethyl)-N-(2-furylmethyl)-3-methyl-butanamide (2R)-2-amino-N-(2-cyanoethyl)-N-…
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) | -0.24 | 4.53 | -53.38 | 3 | 5 | 1 | 85 | 250.322 | 6 | ↓ |
Hi High (pH 8-9.5) | -0.24 | 4.19 | -13.84 | 2 | 5 | 0 | 83 | 249.314 | 6 | ↓ |