In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 6th, 2012 | 28 | Yes |
Popular Name: 4-[[3-(3-fluorophenyl)-1-(m-tolyl)pyrazol-4-yl]methyl]-1-methyl-piperazin-2-one 4-[[3-(3-fluorophenyl)-1-(m-toly…
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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) | 3.05 | 10.94 | -17.76 | 0 | 5 | 0 | 41 | 378.451 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.05 | 11.65 | -59.77 | 1 | 5 | 1 | 43 | 379.459 | 4 | ↓ |