In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 24 | Yes |
Popular Name: 3-[(4-chlorophenyl)methyl]-7-(pyrrolidin-1-ylmethyl)-1,2-benzoxazol-6-ol 3-[(4-chlorophenyl)methyl]-7-(py…
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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) | 4.71 | 9.08 | -36.98 | 2 | 4 | 1 | 51 | 343.834 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.71 | 9.85 | -23.44 | 1 | 4 | 0 | 54 | 342.826 | 4 | ↓ |