In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 18 | Yes |
Popular Name: (1S)-1-(5-bromo-2-furyl)-N-(2-dimethylaminoethyl)-N-propyl-ethane-1,2-diamine (1S)-1-(5-bromo-2-furyl)-N-(2-di…
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) | 1.83 | 4.91 | -106.75 | 4 | 4 | 2 | 48 | 320.275 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.83 | 2.46 | -46.2 | 3 | 4 | 1 | 47 | 319.267 | 8 | ↓ |