In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2010 | 19 | Yes |
Popular Name: 6-methyl-2-[(6S)-2,2,6-trimethylmorpholin-4-yl]pyridine-3-carboxamidine 6-methyl-2-[(6S)-2,2,6-trimethyl…
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) | 0.55 | 4.48 | -35.06 | 4 | 5 | 1 | 77 | 263.365 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.55 | 5.5 | -7.12 | 3 | 5 | 0 | 75 | 262.357 | 2 | ↓ |
Lo Low (pH 4.5-6) | 0.55 | 4.95 | -92.91 | 5 | 5 | 2 | 78 | 264.373 | 2 | ↓ |