In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 11th, 2009 | 18 | Yes |
Popular Name: (1R)-N-methyl-1-(p-tolyl)-N-(2-thienylmethyl)ethane-1,2-diamine (1R)-N-methyl-1-(p-tolyl)-N-(2-t…
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) | 2.48 | 5.82 | -46.84 | 3 | 2 | 1 | 31 | 261.414 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.48 | 7.8 | -123.84 | 4 | 2 | 2 | 32 | 262.422 | 5 | ↓ |