In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 19 | Yes |
Popular Name: (2R)-N1-tert-butyl-N2-[(2-fluorophenyl)methyl]-N2-methyl-butane-1,2-diamine (2R)-N1-tert-butyl-N2-[(2-fluoro…
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) | 3.69 | 9.66 | -105.65 | 3 | 2 | 2 | 21 | 268.42 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.69 | 9.25 | -29.39 | 2 | 2 | 1 | 16 | 267.412 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.69 | 7.12 | -36.02 | 2 | 2 | 1 | 20 | 267.412 | 7 | ↓ |