In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 19th, 2010 | 21 | Yes |
Popular Name: (2S)-2-[2-(aminomethyl)-6-bromo-phenoxy]-N-(2-furylmethyl)propanamide (2S)-2-[2-(aminomethyl)-6-bromo-…
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) | 2.02 | 4.64 | -43.7 | 4 | 5 | 1 | 79 | 354.224 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.02 | 4.21 | -11.03 | 3 | 5 | 0 | 77 | 353.216 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.