In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 20 | Yes |
Popular Name: (2R)-N-[2-(4-pyrimidin-2-ylpiperazin-1-yl)ethyl]pentan-2-amine (2R)-N-[2-(4-pyrimidin-2-ylpiper…
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) | 2.20 | 7.59 | -41.92 | 2 | 5 | 1 | 49 | 278.424 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.20 | 9.8 | -119.78 | 3 | 5 | 2 | 50 | 279.432 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.