In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 23rd, 2008 | 21 | Yes |
Popular Name: 1-(azepan-1-yl)-2-[(2-methyl-6,7-dihydro-5H-cyclopenta[e]pyrimidin-4-yl)sulfanyl]ethanone 1-(azepan-1-yl)-2-[(2-methyl-6,7…
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) | 2.46 | -1.21 | -9.83 | 0 | 4 | 0 | 46 | 305.447 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.