| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 26 | Yes |
Popular Name: (5S)-6-[4-[(4-isopropylphenyl)methyl]piperazin-1-yl]-5H-purin-2-amine (5S)-6-[4-[(4-isopropylphenyl)me…
| 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) | 1.88 | 8.67 | -14.44 | 2 | 7 | 0 | 81 | 351.458 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.88 | 8.66 | -36.34 | 3 | 7 | 1 | 84 | 352.466 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
