In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 25 | No |
Popular Name: 1-(2-methoxyethyl)-3-(2-methyl-5-nitro-phenyl)-1-(3-pyridylmethyl)urea 1-(2-methoxyethyl)-3-(2-methyl-5…
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) | 2.17 | 8.24 | -17.53 | 1 | 8 | 0 | 100 | 344.371 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.17 | 8.7 | -45.83 | 2 | 8 | 1 | 102 | 345.379 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.