In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 16 | Yes |
Popular Name: (1S)-1-(5-bromo-2-furyl)-N,N-dipropyl-ethane-1,2-diamine (1S)-1-(5-bromo-2-furyl)-N,N-dip…
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) | 2.68 | 3.98 | -47.14 | 3 | 3 | 1 | 44 | 290.225 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 6.2 | -124.18 | 4 | 3 | 2 | 45 | 291.233 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.68 | 6.14 | -28.83 | 3 | 3 | 1 | 44 | 290.225 | 7 | ↓ |