In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 29 | No |
Popular Name: N-[3-[isopropyl(methyl)amino]phenyl]-2-oxo-2-[4-(4-pyridylmethyl)piperazin-1-yl]acetamide N-[3-[isopropyl(methyl)amino]phe…
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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) | 1.22 | 6.1 | -7.9 | 1 | 7 | 0 | 69 | 395.507 | 6 | ↓ |
Lo Low (pH 4.5-6) | 1.22 | 8.31 | -46.93 | 2 | 7 | 1 | 70 | 396.515 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.