In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 6th, 2011 | 19 | No |
Popular Name: N-[(E)-[(E)-3-(3-nitrophenyl)prop-2-enylidene]amino]-1H-tetrazol-5-amine N-[(E)-[(E)-3-(3-nitrophenyl)pro…
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) | 1.55 | 6.18 | -41.9 | 1 | 9 | -1 | 123 | 258.221 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.55 | 6.38 | -18.01 | 2 | 9 | 0 | 125 | 259.229 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.