In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 5th, 2009 | 23 | Yes |
Popular Name: 2-[[2-[[(2R)-2-amino-3-(1H-indol-3-yl)propanoyl]amino]acetyl]amino]acetic 2-[[2-[[(2R)-2-amino-3-(1H-indol…
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) | -1.82 | -0.12 | -74.2 | 6 | 8 | 0 | 142 | 318.333 | 7 | ↓ |
Hi High (pH 8-9.5) | -1.82 | -0.44 | -48.49 | 5 | 8 | -1 | 140 | 317.325 | 7 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
PUBCHEM_PATENT_ID | EP0219237A1; EP0475160B1; US4865974; US4870017; US5013662; US5354675; US6165500 | IBM Patent Data |