| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 22nd, 2006 | 27 | Yes |
Popular Name: 7-butyl-8-(4-chlorophenyl)-2-(2-hydroxyphenyl)-3,4,7-triazabicyclo[3.3.0]octa-2,9-dien-6-one 7-butyl-8-(4-chlorophenyl)-2-(2-…
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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) | 4.86 | 8.26 | -12.34 | 2 | 5 | 0 | 69 | 381.863 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.86 | 9.03 | -51.01 | 1 | 5 | -1 | 72 | 380.855 | 5 | ↓ |
