In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2011 | 28 | Yes |
Popular Name: (3R)-4-[(4-fluorophenyl)methyl]-3-isopropyl-1-[2-(2-pyridyl)acetyl]-1,4-diazepan-5-one (3R)-4-[(4-fluorophenyl)methyl]-…
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) | 2.45 | 11.24 | -14.66 | 0 | 5 | 0 | 54 | 383.467 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.