In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 18 | Yes |
Popular Name: 3-amino-4-[methyl-[[(2S)-tetrahydrofuran-2-yl]methyl]amino]benzoic 3-amino-4-[methyl-[[(2S)-tetrahy…
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) | 1.74 | 6.19 | -52.65 | 2 | 5 | -1 | 79 | 249.29 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.74 | 5.44 | -64.57 | 3 | 5 | 0 | 80 | 250.298 | 4 | ↓ |