In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 16 | Yes |
Popular Name: (5R)-7-methoxy-1,1-dioxo-2,3,4,5-tetrahydrobenzo[b]thiepin-5-amine (5R)-7-methoxy-1,1-dioxo-2,3,4,5…
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) | -0.88 | 0.31 | -57.46 | 3 | 4 | 1 | 71 | 242.32 | 1 | ↓ |
Mid Mid (pH 6-8) | -0.88 | 0.69 | -11.08 | 2 | 4 | 0 | 69 | 241.312 | 1 | ↓ |