In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 18 | Yes |
Popular Name: 2-[3-hydroxypropyl(isopropyl)amino]-6-methyl-pyridine-3-carboxamidine 2-[3-hydroxypropyl(isopropyl)ami…
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) | -0.16 | 1.95 | -38.26 | 5 | 5 | 1 | 88 | 251.354 | 6 | ↓ |
Mid Mid (pH 6-8) | -0.16 | 2.03 | -7.97 | 4 | 5 | 0 | 86 | 250.346 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.16 | 2.41 | -90.9 | 6 | 5 | 2 | 89 | 252.362 | 6 | ↓ |