In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 12th, 2008 | 15 | Yes |
Popular Name: [4-[(2-methylimidazol-1-yl)methyl]phenyl]methanamine [4-[(2-methylimidazol-1-yl)methy…
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CAS Number: 954578-11-1
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) | 0.86 | 5.59 | -51.07 | 3 | 3 | 1 | 45 | 202.281 | 3 | ↓ |
Mid Mid (pH 6-8) | 0.86 | 6.05 | -83.61 | 4 | 3 | 2 | 47 | 203.289 | 3 | ↓ |