| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 25th, 2012 | 24 | Yes |
Popular Name: 3-methyl-5-(methylamino)-N-[4-(4-methylpiperazin-1-yl)phenyl]isothiazole-4-carboxamide 3-methyl-5-(methylamino)-N-[4-(4…
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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) | 2.08 | 5.61 | -45.27 | 3 | 6 | 1 | 62 | 346.48 | 4 | ↓ |
| Mid Mid (pH 6-8) | 2.08 | 3.26 | -9.95 | 2 | 6 | 0 | 60 | 345.472 | 4 | ↓ |
