In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 18 | Yes |
Popular Name: (2R)-N2-methyl-N2-(m-tolylmethyl)-N1-propyl-butane-1,2-diamine (2R)-N2-methyl-N2-(m-tolylmethyl…
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) | 3.34 | 10.19 | -117.65 | 3 | 2 | 2 | 21 | 250.43 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.34 | 7.98 | -35.59 | 2 | 2 | 1 | 20 | 249.422 | 8 | ↓ |