In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 3rd, 2011 | 23 | Yes |
Popular Name: 1-[2-[(1R)-2-cyano-1-methyl-ethyl]sulfanylphenyl]-3-[(1-methylcyclopentyl)methyl]urea 1-[2-[(1R)-2-cyano-1-methyl-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) | 3.68 | 9.2 | -13.63 | 2 | 4 | 0 | 65 | 331.485 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.