In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 17 | Yes |
Popular Name: N'-[(5-iodo-2-furyl)methyl]-N,N-diisopropyl-ethane-1,2-diamine N'-[(5-iodo-2-furyl)methyl]-N,N-…
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) | 3.34 | 5.79 | -42.55 | 2 | 3 | 1 | 33 | 351.252 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.34 | 4.43 | -1.84 | 1 | 3 | 0 | 28 | 350.244 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 7.84 | -115.81 | 3 | 3 | 2 | 34 | 352.26 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 6.45 | -31.6 | 2 | 3 | 1 | 30 | 351.252 | 7 | ↓ |