In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: 2-[butyl-[(1S)-1-methylpropyl]amino]-6-methyl-pyridine-3-carboxamidine 2-[butyl-[(1S)-1-methylpropyl]am…
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) | 2.18 | 7.07 | -33.73 | 4 | 4 | 1 | 68 | 263.409 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.18 | 8.57 | -4.68 | 3 | 4 | 0 | 66 | 262.401 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.18 | 7.51 | -89.01 | 5 | 4 | 2 | 69 | 264.417 | 7 | ↓ |