In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2010 | 26 | Yes |
Popular Name: 4-[2-(2-ethylanilino)-2-oxo-ethyl]-N-isopentyl-piperazine-1-carboxamide 4-[2-(2-ethylanilino)-2-oxo-ethy…
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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) | 4.13 | 6.93 | -15.37 | 2 | 6 | 0 | 65 | 360.502 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.13 | 9.1 | -53.43 | 3 | 6 | 1 | 66 | 361.51 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.