In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2009 | 26 | Yes |
Popular Name: N-[2-(4-benzylpiperazin-1-yl)ethyl]-3-chloro-4-hydroxy-benzamide N-[2-(4-benzylpiperazin-1-yl)eth…
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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) | 2.84 | 5.71 | -51.66 | 3 | 5 | 1 | 57 | 374.892 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 3.99 | -44.04 | 1 | 5 | -1 | 59 | 372.876 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 5.67 | -47.08 | 3 | 5 | 1 | 57 | 374.892 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 3.33 | -12.81 | 2 | 5 | 0 | 56 | 373.884 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.84 | 6.37 | -70.65 | 2 | 5 | 0 | 60 | 373.884 | 6 | ↓ |