In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: (2R)-3-[ethyl(7H-purin-6-yl)amino]-2-methyl-propanamidine (2R)-3-[ethyl(7H-purin-6-yl)amin…
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) | 1.07 | 5.8 | -39.69 | 5 | 7 | 1 | 109 | 248.314 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.07 | 6.18 | -83.77 | 6 | 7 | 2 | 111 | 249.322 | 5 | ↓ |