In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2009 | 29 | Yes |
Popular Name: (2S)-2-[1-(carboxymethyl)-5-methoxy-indol-3-yl]-2-[4-(2-cyanoethyl)piperazin-1-yl]acetic (2S)-2-[1-(carboxymethyl)-5-meth…
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) | 0.02 | 9.67 | -67.85 | 1 | 9 | -1 | 126 | 399.427 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.02 | 7.66 | -109.62 | 0 | 9 | -2 | 125 | 398.419 | 8 | ↓ |