In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 20 | No |
Popular Name: (1R)-1-(4-bromophenyl)-3-(1,1-dioxo-1,4-thiazinan-4-yl)-N-methyl-propan-1-amine (1R)-1-(4-bromophenyl)-3-(1,1-di…
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) | 1.15 | 3.54 | -59.83 | 2 | 4 | 1 | 54 | 362.313 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.15 | 2.4 | -11.08 | 1 | 4 | 0 | 49 | 361.305 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.