In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 20 | Yes |
Popular Name: 3-(1-methyltetrazol-5-yl)sulfanyl-N-[(1S)-1-(4-pyridyl)ethyl]propanamide 3-(1-methyltetrazol-5-yl)sulfany…
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) | 0.28 | 3.75 | -18.06 | 1 | 7 | 0 | 86 | 292.368 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.28 | 4.2 | -52.04 | 2 | 7 | 1 | 87 | 293.376 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.