In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 25 | No |
Popular Name: N'-[2-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]ethyl]-N-isopropyl-oxamide N'-[2-[4-[(4-chlorophenyl)methyl…
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) | 1.20 | 4.4 | -46.82 | 3 | 6 | 1 | 66 | 367.901 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 4.39 | -46.24 | 3 | 6 | 1 | 66 | 367.901 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.20 | 2.01 | -7.88 | 2 | 6 | 0 | 65 | 366.893 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.