In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 16th, 2004 | 15 | Yes |
Popular Name: Acetic acid, [(4-ethyl-5-propyl-4H-1,2,4-triazol-3-yl)thio]- (9CI) Acetic acid, [(4-ethyl-5-propyl-…
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CAS Number: 603071-16-5
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) | 1.16 | 7.65 | -47.5 | 0 | 5 | -1 | 71 | 228.297 | 6 | ↓ |