In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 13th, 2008 | 17 | Yes |
Popular Name: (1S)-1-(5-bromo-2-furyl)-N-cyclohexyl-N-methyl-ethane-1,2-diamine (1S)-1-(5-bromo-2-furyl)-N-cyclo…
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) | 2.82 | 4.61 | -41.5 | 3 | 3 | 1 | 44 | 302.236 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 6.58 | -121.49 | 4 | 3 | 2 | 45 | 303.244 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.82 | 5.85 | -29.91 | 3 | 3 | 1 | 44 | 302.236 | 4 | ↓ |