| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 15th, 2011 | 14 | Yes |
Popular Name: (1S)-N'-cyclopentyl-1-cyclopropyl-N'-ethyl-ethane-1,2-diamine (1S)-N'-cyclopentyl-1-cyclopropy…
| 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) | 1.85 | 6.58 | -112.62 | 4 | 2 | 2 | 32 | 198.354 | 5 | ↓ |
| Hi High (pH 8-9.5) | 1.85 | 4.96 | -36.06 | 3 | 2 | 1 | 31 | 197.346 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.85 | 6.36 | -28.08 | 3 | 2 | 1 | 30 | 197.346 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
