In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 25 | Yes |
Popular Name: 3-benzyl-7-[(dipropylamino)methyl]-1,2-benzoxazol-6-ol 3-benzyl-7-[(dipropylamino)methy…
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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) | 5.38 | 10.55 | -36.11 | 2 | 4 | 1 | 51 | 339.459 | 8 | ↓ |
Mid Mid (pH 6-8) | 5.38 | 11.11 | -22.83 | 1 | 4 | 0 | 54 | 338.451 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.