In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 19 | Yes |
Popular Name: 3-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-1-pyrrolidin-1-yl-propan-1-one 3-[[(1R)-1-(4-chlorophenyl)ethyl…
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) | 2.76 | 8.07 | -50.87 | 2 | 3 | 1 | 37 | 281.807 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.76 | 6.81 | -8.85 | 1 | 3 | 0 | 32 | 280.799 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.