In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 17 | No |
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) | 1.50 | 6.42 | -7.35 | 2 | 2 | 0 | 29 | 266.435 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.50 | 7.27 | -43.63 | 3 | 2 | 1 | 30 | 267.443 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.