In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 26th, 2004 | 28 | Yes |
Popular Name: 2-[[4-chloro-6-[(3R)-4-(3-fluorobenzoyl)-3-methyl-piperazino]pyrimidin-2-yl]thio]acetate 2-[[4-chloro-6-[(3R)-4-(3-fluoro…
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) | 2.90 | 10.33 | -48.15 | 0 | 7 | -1 | 89 | 423.877 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.