In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 12 | Yes |
Popular Name: 2-METHYL-1,2,3,4-TETRAHYDROISOQUINOLIN-7-AMINE 2-METHYL-1,2,3,4-TETRAHYDROISOQU…
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CAS Number: 14097-40-6
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) | 0.79 | 4.74 | -35.54 | 3 | 2 | 1 | 30 | 163.244 | 0 | ↓ |
Hi High (pH 8-9.5) | 0.79 | 2.28 | -4.58 | 2 | 2 | 0 | 29 | 162.236 | 0 | ↓ |