In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 18 | Yes |
Popular Name: (1R)-N-methyl-N-(m-tolylmethyl)-1-(2-thienyl)ethane-1,2-diamine (1R)-N-methyl-N-(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) | 2.45 | 5.81 | -45.94 | 3 | 2 | 1 | 31 | 261.414 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.45 | 5.46 | -2.61 | 2 | 2 | 0 | 29 | 260.406 | 5 | ↓ |