In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 16th, 2010 | 29 | Yes |
Popular Name: N-(3-hydroxy-2,2-dimethyl-propyl)-1-[1-(o-tolylmethyl)-4-piperidyl]piperidine-4-carboxamide N-(3-hydroxy-2,2-dimethyl-propyl…
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) | 2.97 | 7.62 | -44.23 | 3 | 5 | 1 | 57 | 402.603 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.97 | 7.65 | -45.15 | 3 | 5 | 1 | 57 | 402.603 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.