In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2011 | 20 | Yes |
Popular Name: 1-ethyl-3-[1-(4-methylpiperazine-1-carbonyl)cyclopentyl]urea 1-ethyl-3-[1-(4-methylpiperazine…
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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) | 0.84 | 1.83 | -17.9 | 2 | 6 | 0 | 65 | 282.388 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.84 | 4.21 | -52.85 | 3 | 6 | 1 | 66 | 283.396 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.