In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: (1R)-1-(3,5-dimethylphenyl)-N-methyl-N-(2-thienylmethyl)ethane-1,2-diamine (1R)-1-(3,5-dimethylphenyl)-N-me…
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) | 2.85 | 6.59 | -51.85 | 3 | 2 | 1 | 31 | 275.441 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.85 | 8.4 | -121.47 | 4 | 2 | 2 | 32 | 276.449 | 5 | ↓ |