In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 25th, 2009 | 26 | Yes |
Popular Name: 4-tert-butyl-N-[3-(4-isopropylpiperazin-1-yl)-3-oxo-propyl]benzamide 4-tert-butyl-N-[3-(4-isopropylpi…
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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) | 3.02 | 7.07 | -16.96 | 1 | 5 | 0 | 53 | 359.514 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 9.21 | -53.25 | 2 | 5 | 1 | 54 | 360.522 | 6 | ↓ |