In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 24th, 2013 | 23 | Yes |
Popular Name: 5-(3,5-dimethylpiperazin-1-ylsulfonyl)-2-ethoxybenzoic acid 5-(3,5-dimethylpiperazin-1-ylsul…
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CAS Number: 496835-32-6
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) | 1.91 | 4.91 | -81.34 | 2 | 7 | 0 | 103 | 342.417 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.91 | 3.83 | -58.64 | 1 | 7 | -1 | 99 | 341.409 | 5 | ↓ |
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