In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 18th, 2011 | 24 | Yes |
Popular Name: [3-[(2-amino-8,9-dimethyl-purin-6-yl)amino]phenyl]methanesulfonamide [3-[(2-amino-8,9-dimethyl-purin-…
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) | 1.43 | 3.65 | -21.6 | 5 | 9 | 0 | 142 | 347.404 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.43 | 3.83 | -37.67 | 6 | 9 | 1 | 143 | 348.412 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.