In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 21 | Yes |
Popular Name: (2R)-2-amino-N-(2-cyanoethyl)-2-methyl-N-(2-morpholinoethyl)pentanamide (2R)-2-amino-N-(2-cyanoethyl)-2-…
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) | 0.28 | 2.87 | -54.22 | 3 | 6 | 1 | 84 | 297.423 | 8 | ↓ |
Hi High (pH 8-9.5) | 0.28 | 2.66 | -11.88 | 2 | 6 | 0 | 83 | 296.415 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.28 | 5.16 | -143.45 | 4 | 6 | 2 | 85 | 298.431 | 8 | ↓ |