In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 13th, 2008 | 26 | No |
Popular Name: 3-[(5R)-4-(cyclopropanecarbonyl)-3-hydroxy-2-oxo-5-(3-thienyl)-5H-pyrrol-1-yl]benzoic 3-[(5R)-4-(cyclopropanecarbonyl)…
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) | 2.44 | 9.5 | -130.71 | 0 | 6 | -2 | 101 | 367.382 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.86 | 8.48 | -76.77 | 0 | 6 | -1 | 95 | 368.39 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.44 | 7.17 | -84.72 | 1 | 6 | -1 | 98 | 368.39 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.