In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2008 | 18 | Yes |
Popular Name: 4-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid 4-methyl-2-(1H-pyrrol-1-yl)-4,5,…
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CAS Number: 910443-65-1
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) | 3.16 | 0.79 | -60.98 | 0 | 3 | -1 | 45 | 260.338 | 2 | ↓ |