In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2008 | 15 | No |
Popular Name: 4-Amino-5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidine-2-thiol 4-Amino-5,6,7,8-tetrahydro-benzo…
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CAS Number: 121746-10-9
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) | 2.07 | 5.5 | -19.01 | 3 | 3 | 0 | 55 | 237.353 | 0 | ↓ |
Lo Low (pH 4.5-6) | 2.79 | 5.03 | -22.94 | 3 | 3 | 1 | 53 | 238.361 | 0 | ↓ |
Lo Low (pH 4.5-6) | 2.79 | 0.81 | -22.44 | 3 | 3 | 1 | 53 | 238.361 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |