In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 2nd, 2008 | 20 | No |
Popular Name: N-(2-carbamothioylphenyl)-2-(3-oxopiperazin-1-yl)acetamide N-(2-carbamothioylphenyl)-2-(3-o…
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) | 0.73 | 2.55 | -43.28 | 5 | 6 | 1 | 89 | 293.372 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.73 | 0.28 | -19.08 | 4 | 6 | 0 | 87 | 292.364 | 4 | ↓ |