In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 17 | Yes |
Popular Name: 2-[methyl(3-thienylmethyl)amino]pyridine-4-carboxamidine 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) | 0.47 | 5.53 | -94.38 | 5 | 4 | 2 | 69 | 248.355 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.47 | 5.56 | -35.87 | 4 | 4 | 1 | 67 | 247.347 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.47 | 5.21 | -36.03 | 4 | 4 | 1 | 68 | 247.347 | 4 | ↓ |