In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 12th, 2010 | 12 | Yes |
Popular Name: 3-chloro-2-(methylamino)benzoic acid 3-chloro-2-(methylamino)benzoic …
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CAS Number: [937696-42-9]
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) | 2.47 | 4.44 | -44.35 | 1 | 3 | -1 | 52 | 184.602 | 2 | ↓ |
Lo Low (pH 4.5-6) | 2.47 | 2.45 | -5.59 | 2 | 3 | 0 | 49 | 185.61 | 2 | ↓ |