In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 22nd, 2010 | 20 | Yes |
Popular Name: (2R)-2-cyano-3-methyl-N-(2-methyl-4-quinolyl)butanamide (2R)-2-cyano-3-methyl-N-(2-methy…
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) | 3.82 | 6.81 | -11.97 | 1 | 4 | 0 | 66 | 267.332 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.82 | 7.19 | -30.68 | 2 | 4 | 1 | 67 | 268.34 | 3 | ↓ |