In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 27th, 2010 | 21 | Yes |
Popular Name: 4-imino-3-phenyl-5,6,7,8-tetrahydro-1H-benzothiopheno[2,3-d]pyrimidin-2-one 4-imino-3-phenyl-5,6,7,8-tetrahy…
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) | 3.06 | 7.37 | -18.33 | 2 | 4 | 0 | 61 | 297.383 | 1 | ↓ |
Mid Mid (pH 6-8) | 3.06 | 8.5 | -25.04 | 3 | 4 | 1 | 62 | 298.391 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.