In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 20 | Yes |
Popular Name: (1S)-1-(3,5-dimethylphenyl)-N-methyl-N-[(2-methylthiazol-4-yl)methyl]ethane-1,2-diamine (1S)-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) | 1.84 | 5.09 | -44.36 | 3 | 3 | 1 | 44 | 290.456 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.84 | 7.07 | -119.1 | 4 | 3 | 2 | 45 | 291.464 | 5 | ↓ |