In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 19 | Yes |
Popular Name: (1R)-N'-[(1S)-1-cyclopropylethyl]-1-(4-ethylphenyl)-N,N'-dimethyl-ethane-1,2-diamine (1R)-N'-[(1S)-1-cyclopropylethyl…
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) | 3.82 | 10.5 | -117.38 | 3 | 2 | 2 | 21 | 262.441 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.82 | 8.49 | -34.57 | 2 | 2 | 1 | 20 | 261.433 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.82 | 9.41 | -30.91 | 2 | 2 | 1 | 16 | 261.433 | 7 | ↓ |