In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 21 | Yes |
Popular Name: 2-[[(3S)-3-carboxy-3,4-dimethyl-pentanoyl]amino]benzoic 2-[[(3S)-3-carboxy-3,4-dimethyl-…
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) | 2.41 | 8.34 | -108.92 | 1 | 6 | -2 | 109 | 291.303 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.41 | 6.01 | -47.33 | 2 | 6 | -1 | 107 | 292.311 | 6 | ↓ |