In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 10th, 2011 | 30 | Yes |
Popular Name: (3R)-N-(4-acetamidophenyl)-1-(2-ethylthieno[3,2-c]pyridin-4-yl)piperidine-3-carboxamide (3R)-N-(4-acetamidophenyl)-1-(2-…
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) | 3.62 | 10.32 | -42.7 | 3 | 6 | 1 | 76 | 423.562 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.62 | 9.84 | -19.27 | 2 | 6 | 0 | 74 | 422.554 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.