In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 16 | No |
Popular Name: (4-amino-1H-pyrrol-2-yl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone (4-amino-1H-pyrrol-2-yl)-(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) | -0.80 | -1.28 | -16.53 | 3 | 6 | 0 | 96 | 243.288 | 1 | ↓ |
Mid Mid (pH 6-8) | -1.24 | -2.45 | -62.54 | 3 | 6 | 1 | 94 | 244.296 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.