In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 16 | Yes |
Popular Name: 2-[[(1R)-1,2-dimethylpropyl]-methyl-amino]pyridine-4-carboxamidine 2-[[(1R)-1,2-dimethylpropyl]-met…
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) | 0.93 | 5.67 | -90.32 | 5 | 4 | 2 | 69 | 222.336 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 5.71 | -31.91 | 4 | 4 | 1 | 67 | 221.328 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.93 | 5.28 | -35.44 | 4 | 4 | 1 | 68 | 221.328 | 4 | ↓ |