In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2009 | 17 | Yes |
Popular Name: N-[(4-methyl-1,2,4-triazol-3-yl)methyl]thieno[2,3-e]pyrimidin-4-amine N-[(4-methyl-1,2,4-triazol-3-yl)…
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) | 0.30 | 6.5 | -14.44 | 1 | 6 | 0 | 69 | 246.299 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.30 | 6.93 | -39.64 | 2 | 6 | 1 | 70 | 247.307 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.