In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2008 | 23 | Yes |
Popular Name: 6-chloro-2-[(4-methylsulfonylpiperazin-1-yl)methyl]-3H-quinazolin-4-one 6-chloro-2-[(4-methylsulfonylpip…
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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) | 0.81 | 2.11 | -16.51 | 1 | 7 | 0 | 86 | 356.835 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.81 | 4.27 | -61.57 | 2 | 7 | 1 | 88 | 357.843 | 3 | ↓ |