In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 27 | No |
Popular Name: 4-hydroxy-3-nitro-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide 4-hydroxy-3-nitro-N-[4-(pyrrolid…
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) | 1.74 | 5.18 | -51.95 | 1 | 9 | -1 | 135 | 390.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 4.23 | -44.72 | 1 | 9 | -1 | 135 | 390.397 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 4.19 | -24.81 | 2 | 9 | 0 | 133 | 391.405 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.74 | 5.21 | -93.34 | 0 | 9 | -2 | 137 | 389.389 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.