In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2004 | 18 | Yes |
Popular Name: (3S)-3-ammonio-3-(5-tert-butyl-2-methoxy-phenyl)propionate (3S)-3-ammonio-3-(5-tert-butyl-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) | 0.63 | 5.75 | -37.72 | 3 | 4 | 0 | 77 | 251.326 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.63 | 5.43 | -46.78 | 2 | 4 | -1 | 75 | 250.318 | 5 | ↓ |