In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 18 | Yes |
Popular Name: (1S,2S)-N2-[(1S)-1-cyclopropylethyl]-N1-ethyl-N2-(2-methoxyethyl)cyclopentane-1,2-diamine (1S,2S)-N2-[(1S)-1-cyclopropylet…
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) | 2.57 | 7.3 | -104.02 | 3 | 3 | 2 | 30 | 256.434 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.57 | 4.22 | -1.22 | 1 | 3 | 0 | 24 | 254.418 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 5.34 | -37.05 | 2 | 3 | 1 | 29 | 255.426 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.57 | 6.17 | -27.1 | 2 | 3 | 1 | 26 | 255.426 | 8 | ↓ |