In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 24th, 2004 | 22 | No |
Popular Name: 6-Amino-2-chloromethyl-5-cyano-4-phenyl-4 H -pyran-3-carboxylic acid ethyl ester 6-Amino-2-chloromethyl-5-cyano-4…
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CAS Number: 340808-52-8
6-Amino-2-chloromethyl-5-cyano-4-phenyl-4 H -pyran
6-Amino-2-chloromethyl-5-cyano-4-phenyl-4H-pyran-3-carboxylic acid ethyl ester
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) | 3.19 | 1.55 | -6.7 | 2 | 5 | 0 | 85 | 318.76 | 5 | ↓ |