In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2010 | 24 | No |
Popular Name: 6-(benzimidazol-1-yl)-N-[(1R)-2-methoxy-1-methyl-ethyl]-5-nitro-pyrimidin-4-amine 6-(benzimidazol-1-yl)-N-[(1R)-2-…
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) | 1.79 | 9.85 | -11.54 | 1 | 9 | 0 | 111 | 328.332 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.79 | 10.33 | -25.9 | 2 | 9 | 1 | 112 | 329.34 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.