In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 15 | Yes |
Popular Name: (2S)-N-(2-furylmethyl)-1-(1,2,4-triazol-1-yl)propan-2-amine (2S)-N-(2-furylmethyl)-1-(1,2,4-…
None
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) | 0.23 | 6.77 | -39.15 | 2 | 5 | 1 | 60 | 207.257 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.23 | 5.56 | -10.02 | 1 | 5 | 0 | 56 | 206.249 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.