In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2010 | 21 | Yes |
Popular Name: N-(3-amino-4-pyridyl)-2-(1,2-benzoxazol-3-yl)-N-methyl-acetamide N-(3-amino-4-pyridyl)-2-(1,2-ben…
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) | 1.54 | 4.82 | -20.24 | 2 | 6 | 0 | 85 | 282.303 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.54 | 5.27 | -46.26 | 3 | 6 | 1 | 87 | 283.311 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.