In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 20 | Yes |
Popular Name: N'-cyclopropyl-N'-(2-furylmethyl)-N-(3-isopropoxypropyl)ethane-1,2-diamine N'-cyclopropyl-N'-(2-furylmethyl…
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) | 1.79 | 5.95 | -42.77 | 2 | 4 | 1 | 42 | 281.42 | 11 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 8.37 | -119.67 | 3 | 4 | 2 | 43 | 282.428 | 11 | ↓ |
Mid Mid (pH 6-8) | 1.79 | 7.01 | -34.19 | 2 | 4 | 1 | 39 | 281.42 | 11 | ↓ |
No pre-computed analogs available. Try a structural similarity search.