In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | No |
Popular Name: 4-[(3-amino-4-pyridyl)sulfanylmethyl]-3-nitro-benzamide 4-[(3-amino-4-pyridyl)sulfanylme…
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) | 1.01 | 2.95 | -18.7 | 4 | 7 | 0 | 128 | 304.331 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.01 | 3.41 | -47.46 | 5 | 7 | 1 | 129 | 305.339 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.