In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 16 | Yes |
Popular Name: 2,4-Quinazolinediamine, 6,7-dimethoxy- 2,4-Quinazolinediamine, 6,7-dime…
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CAS Numbers: 60547-96-8 , 605747-96-8
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) | 0.57 | 2.13 | -11 | 4 | 6 | 0 | 96 | 220.232 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.57 | 2.49 | -29.9 | 5 | 6 | 1 | 98 | 221.24 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.57 | -3.22 | -29.84 | 5 | 6 | 1 | 98 | 221.24 | 2 | ↓ |