In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 19 | Yes |
Popular Name: (1R)-1-(3,5-dimethylphenyl)-N-ethyl-N-[(1S)-2-methoxy-1-methyl-ethyl]ethane-1,2-diamine (1R)-1-(3,5-dimethylphenyl)-N-et…
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) | 2.24 | 6.62 | -119.42 | 4 | 3 | 2 | 41 | 266.429 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 4.6 | -40.86 | 3 | 3 | 1 | 40 | 265.421 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 6.53 | -25.48 | 3 | 3 | 1 | 40 | 265.421 | 7 | ↓ |