In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 9th, 2011 | 22 | No |
Popular Name: N'-(3-fluorophenyl)-N-methyl-N-[(1S)-1-(4-pyridyl)ethyl]oxamide N'-(3-fluorophenyl)-N-methyl-N-[…
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) | 1.27 | 6.29 | -9.35 | 1 | 5 | 0 | 62 | 301.321 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.27 | 6.74 | -40.11 | 2 | 5 | 1 | 64 | 302.329 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.