In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 5th, 2006 | 21 | No |
Popular Name: 4-chloro-3-nitro-N-(6-thia-8-azabicyclo[3.3.0]octa-7,9-dien-7-yl)benzamide 4-chloro-3-nitro-N-(6-thia-8-aza…
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) | 3.42 | 8.16 | -21.03 | 1 | 6 | 0 | 88 | 323.761 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.48 | 7.28 | -43.67 | 0 | 6 | -1 | 94 | 322.753 | 3 | ↓ |