In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 15th, 2008 | 24 | No |
Popular Name: 3-hydroxy-4-nitro-N-(6-pyrrolidin-1-yl-3-pyridyl)benzamide 3-hydroxy-4-nitro-N-(6-pyrrolidi…
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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) | 2.27 | 6.14 | -52.23 | 1 | 8 | -1 | 114 | 327.32 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.27 | 5.12 | -19.16 | 2 | 8 | 0 | 111 | 328.328 | 4 | ↓ |
Lo Low (pH 4.5-6) | 2.27 | 5.32 | -51.36 | 3 | 8 | 1 | 113 | 329.336 | 4 | ↓ |