In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 18 | Yes |
Popular Name: (1R)-N,N-diethyl-1-phenyl-N'-sec-butyl-ethane-1,2-diamine (1R)-N,N-diethyl-1-phenyl-N'-sec…
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) | 3.67 | 9.57 | -110.81 | 3 | 2 | 2 | 21 | 250.43 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.67 | 8.26 | -29.91 | 2 | 2 | 1 | 16 | 249.422 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 7.59 | -33.26 | 2 | 2 | 1 | 20 | 249.422 | 8 | ↓ |