In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2011 | 20 | Yes |
Popular Name: 2-chloro-4-methoxy-6-[(3R)-3-(1-piperidyl)pyrrolidin-1-yl]-1,3,5-triazine 2-chloro-4-methoxy-6-[(3R)-3-(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) | 3.10 | 6.94 | -41.14 | 1 | 6 | 1 | 56 | 298.798 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.10 | 4.79 | -5.56 | 0 | 6 | 0 | 54 | 297.79 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.