In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 21 | Yes |
Popular Name: 4-amino-2-[[(2S)-2,3-dihydrobenzofuran-2-yl]methylamino]benzoic 4-amino-2-[[(2S)-2,3-dihydrobenz…
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) | 2.55 | 5.73 | -58.95 | 3 | 5 | -1 | 87 | 283.307 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.55 | 3.74 | -11.4 | 4 | 5 | 0 | 85 | 284.315 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.