| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 29th, 2008 | 25 | Yes |
Popular Name: 5-(3,4-dimethylphenyl)-4-methyl-3-(4-propylpiperazin-1-yl)isothiazole 5-(3,4-dimethylphenyl)-4-methyl-…
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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) | 3.49 | 8.1 | -66.37 | 1 | 5 | 1 | 54 | 362.519 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.49 | 5.77 | -19.76 | 0 | 5 | 0 | 53 | 361.511 | 4 | ↓ |
