In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 18 | Yes |
Popular Name: N4-[(1S)-1-(2,5-dimethyl-3-furyl)ethyl]-6-methyl-pyrimidine-2,4-diamine N4-[(1S)-1-(2,5-dimethyl-3-furyl…
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) | 1.58 | 6.73 | -30.5 | 4 | 5 | 1 | 78 | 247.322 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.58 | 6.28 | -8.68 | 3 | 5 | 0 | 77 | 246.314 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.