In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 18 | Yes |
Popular Name: 4-chloro-2-{[(3-chloro-2-methylphenyl)amino]methyl}phenol 4-chloro-2-{[(3-chloro-2-methylp…
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CAS Number: [1040002-25-2]
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) | 4.82 | 6.03 | -7 | 2 | 2 | 0 | 32 | 282.17 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.82 | 6.81 | -35.2 | 1 | 2 | -1 | 35 | 281.162 | 3 | ↓ |