In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 13 | Yes |
Popular Name: N*1*-Cyclopropyl-N*1*-furan-2-ylmethyl-ethane-1,2-diamine N*1*-Cyclopropyl-N*1*-furan-2-yl…
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CAS Number: 1181600-70-3
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) | 0.17 | 1.8 | -47.72 | 3 | 3 | 1 | 44 | 181.259 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.17 | 3.96 | -115.18 | 4 | 3 | 2 | 45 | 182.267 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.17 | 3.72 | -31.12 | 3 | 3 | 1 | 44 | 181.259 | 5 | ↓ |