In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2010 | 15 | Yes |
Popular Name: (2R)-3-[(2-amino-6-methyl-pyrimidin-4-yl)-methyl-amino]-2-methyl-propanenitrile (2R)-3-[(2-amino-6-methyl-pyrimi…
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) | 1.01 | 6.5 | -33.5 | 3 | 5 | 1 | 80 | 206.273 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.01 | 6.41 | -33.98 | 3 | 5 | 1 | 80 | 206.273 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.01 | 6.05 | -10.05 | 2 | 5 | 0 | 79 | 205.265 | 3 | ↓ |