In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 27th, 2011 | 28 | Yes |
Popular Name: 4-[[4-(thiophene-2-carbonyl)piperazin-1-yl]methyl]-7,8-dihydro-6H-cyclopenta[g]chromen-2-one 4-[[4-(thiophene-2-carbonyl)pipe…
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) | 2.96 | 9.87 | -14.88 | 0 | 5 | 0 | 54 | 394.496 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.96 | 12.06 | -65.31 | 1 | 5 | 1 | 55 | 395.504 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.