In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 34 | Yes |
Popular Name: 3-cyclohexyl-5-[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-[1,2,4]triazolo[4,3-c]quinazoline 3-cyclohexyl-5-[4-[(2-methoxyphe…
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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) | 4.88 | 15.13 | -11.37 | 0 | 7 | 0 | 59 | 456.594 | 5 | ↓ |
Mid Mid (pH 6-8) | 4.88 | 17.38 | -51.06 | 1 | 7 | 1 | 60 | 457.602 | 5 | ↓ |