In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 30th, 2012 | 26 | Yes |
Popular Name: 4-(4-Benzyloxy-phenyl)-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylic acid 4-(4-Benzyloxy-phenyl)-4,5,6,7-t…
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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) | 1.21 | 9.89 | -37.47 | 3 | 6 | 0 | 95 | 349.39 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 9.17 | -59.41 | 3 | 6 | 0 | 91 | 349.39 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 8.7 | -53.57 | 2 | 6 | -1 | 90 | 348.382 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 8.71 | -49.74 | 2 | 6 | -1 | 90 | 348.382 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.21 | 10.35 | -78.18 | 4 | 6 | 1 | 96 | 350.398 | 5 | ↓ |