In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2006 | 13 | No |
Popular Name: 4-Oxo-3,4-dihydroquinazoline-2-carbaldehyde 4-Oxo-3,4-dihydroquinazoline-2-c…
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CAS Number: 104968-03-8
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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) | 0.88 | 2.45 | -13.56 | 1 | 4 | 0 | 63 | 174.159 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.34 | 0.47 | -50.72 | 0 | 4 | -1 | 66 | 173.151 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.88 | 1.86 | -27.03 | 1 | 4 | 0 | 63 | 174.159 | 1 | ↓ |