In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 21st, 2011 | 19 | Yes |
Popular Name: (1S)-N-(cyclopropylmethyl)-1-(2,3-dihydrobenzofuran-5-yl)-N-ethyl-ethane-1,2-diamine (1S)-N-(cyclopropylmethyl)-1-(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) | 2.00 | 5.33 | -50.77 | 3 | 3 | 1 | 40 | 261.389 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.00 | 6.47 | -129.47 | 4 | 3 | 2 | 41 | 262.397 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.