In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 5th, 2010 | 20 | Yes |
Popular Name: Butanoic acid, 4-[(6-hydroxy-4,5,7-trimethyl-2-benzothiazolyl)amino]- Butanoic acid, 4-[(6-hydroxy-4,5…
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CAS Number: 120164-96-7
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) | 3.03 | 5.67 | -46.96 | 2 | 5 | -1 | 85 | 293.368 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.03 | 6.06 | -48.39 | 3 | 5 | 0 | 87 | 294.376 | 5 | ↓ |