In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 11th, 2010 | 26 | Yes |
Popular Name: 2-[1-[[4-(diethylaminomethyl)-5-ethyl-furan-2-carbonyl]amino]cyclohexyl]acetic 2-[1-[[4-(diethylaminomethyl)-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) | 3.16 | 11.24 | -64.95 | 2 | 6 | 0 | 87 | 364.486 | 9 | ↓ |
Hi High (pH 8-9.5) | 3.16 | 9.19 | -50.78 | 1 | 6 | -1 | 86 | 363.478 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.