In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2009 | 17 | Yes |
Popular Name: 2-[methyl(3-thienylmethyl)amino]pyridine-4-carboxylic 2-[methyl(3-thienylmethyl)amino]…
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) | 1.99 | 8.2 | -46.16 | 1 | 4 | 0 | 58 | 248.307 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.99 | 7.88 | -48.02 | 0 | 4 | -1 | 56 | 247.299 | 4 | ↓ |