In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 17 | Yes |
Popular Name: 4(3H)-Quinazolinone, 3-butyl-8-hydroxy-2-methyl- 4(3H)-Quinazolinone, 3-butyl-8-h…
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CAS Number: 100615-74-5
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) | 2.31 | 4.72 | -11.78 | 1 | 4 | 0 | 55 | 232.283 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.31 | 5.49 | -50.45 | 0 | 4 | -1 | 58 | 231.275 | 3 | ↓ |