| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 22nd, 2009 | 20 | Yes |
Popular Name: (2S)-4-(1,3-benzothiazol-2-ylmethyl)-N-methyl-piperazine-2-carboxamide (2S)-4-(1,3-benzothiazol-2-ylmet…
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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) | 0.65 | 1.68 | -43.71 | 3 | 5 | 1 | 62 | 291.4 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.65 | 0.39 | -14.35 | 2 | 5 | 0 | 57 | 290.392 | 3 | ↓ |
| Lo Low (pH 4.5-6) | 0.65 | 4.01 | -126.35 | 4 | 5 | 2 | 63 | 292.408 | 3 | ↓ |
