In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 20 | No |
Popular Name: N-[[4-(cyclopentoxy)-3-nitro-phenyl]methyl]propan-1-amine N-[[4-(cyclopentoxy)-3-nitro-phe…
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) | 3.72 | 9.66 | -55.69 | 2 | 5 | 1 | 72 | 279.36 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.72 | 8.3 | -9.97 | 1 | 5 | 0 | 67 | 278.352 | 7 | ↓ |