| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 21st, 2010 | 18 | Yes |
Popular Name: N'-cyclopropyl-N-isopentyl-N'-(2-thienylmethyl)ethane-1,2-diamine N'-cyclopropyl-N-isopentyl-N'-(2…
| 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) | 3.09 | 7.41 | -40.2 | 2 | 2 | 1 | 20 | 267.462 | 9 | ↓ |
| Hi High (pH 8-9.5) | 3.09 | 6.06 | -1.92 | 1 | 2 | 0 | 15 | 266.454 | 9 | ↓ |
| Lo Low (pH 4.5-6) | 3.09 | 9.47 | -115.58 | 3 | 2 | 2 | 21 | 268.47 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
