In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 30th, 2011 | 29 | Yes |
Popular Name: 1-[(2-hydroxyphenyl)methyl]-3-[1-(o-tolylmethyl)-4-piperidyl]-1-propyl-urea 1-[(2-hydroxyphenyl)methyl]-3-[1…
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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) | 4.98 | 12.53 | -40.47 | 3 | 5 | 1 | 57 | 396.555 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.98 | 10.59 | -8.98 | 2 | 5 | 0 | 56 | 395.547 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.