In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2009 | 12 | Yes |
Popular Name: (2R)-2-methyl-3-(2-thienylmethylamino)propanenitrile (2R)-2-methyl-3-(2-thienylmethyl…
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) | 1.93 | 5.48 | -51.48 | 2 | 2 | 1 | 40 | 181.284 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.93 | 4.12 | -5.95 | 1 | 2 | 0 | 36 | 180.276 | 4 | ↓ |