In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2011 | 29 | Yes |
Popular Name: 6-[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl-1-methyl-pyrido[2,3-d]pyrimidine-2,4-dione 6-[4-(3-chlorophenyl)piperazin-1…
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) | 1.50 | 4.47 | -13.12 | 1 | 9 | 0 | 108 | 435.893 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.96 | 1.96 | -47.1 | 0 | 9 | -1 | 111 | 434.885 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.