In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 21st, 2009 | 15 | Yes |
Popular Name: (2R)-3,3-dimethyl-1-(4-methyl-1,4-diazepan-1-yl)butan-2-amine (2R)-3,3-dimethyl-1-(4-methyl-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) | 1.07 | 4.33 | -90.32 | 4 | 3 | 2 | 35 | 215.385 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 2.37 | -38.1 | 3 | 3 | 1 | 34 | 214.377 | 3 | ↓ |