In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 3rd, 2010 | 27 | Yes |
Popular Name: N-[3-(4-benzylpiperazin-1-yl)propyl]-3-chloro-4-hydroxy-benzamide N-[3-(4-benzylpiperazin-1-yl)pro…
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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) | 3.11 | 6.43 | -51.14 | 3 | 5 | 1 | 57 | 388.919 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.11 | 4.93 | -41.99 | 1 | 5 | -1 | 59 | 386.903 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.11 | 4.16 | -12.02 | 2 | 5 | 0 | 56 | 387.911 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.11 | 6.42 | -47.73 | 3 | 5 | 1 | 57 | 388.919 | 7 | ↓ |