In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: 6-methyl-2-[methyl-[(2S)-2-methylbutyl]amino]pyridine-3-carboxamidine 6-methyl-2-[methyl-[(2S)-2-methy…
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) | 1.16 | 6.17 | -33.3 | 4 | 4 | 1 | 68 | 235.355 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.16 | 7.15 | -6.73 | 3 | 4 | 0 | 66 | 234.347 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 6.07 | -87.96 | 5 | 4 | 2 | 69 | 236.363 | 5 | ↓ |