In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 17 | Yes |
Popular Name: (2R)-2-(4-methyl-1,4-diazepan-1-yl)-2-(5-methyl-2-furyl)ethanamine (2R)-2-(4-methyl-1,4-diazepan-1-…
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) | 0.37 | 4.15 | -99.11 | 4 | 4 | 2 | 48 | 239.363 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.37 | 1.76 | -45.54 | 3 | 4 | 1 | 47 | 238.355 | 3 | ↓ |