In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 10th, 2006 | 26 | No |
Popular Name: 5-(4-bromophenyl)-N-[(2-hydroxy-1H-indol-3-yl)imino]-2H-pyrazole-3-carboxamide 5-(4-bromophenyl)-N-[(2-hydroxy-…
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) | 3.44 | 5.18 | -17.32 | 3 | 7 | 0 | 103 | 410.231 | 3 | ↓ |
Ref Reference (pH 7) | 3.44 | 5.31 | -11.5 | 3 | 7 | 0 | 103 | 410.231 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.89 | 3.22 | -57.42 | 2 | 7 | -1 | 106 | 409.223 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.89 | 3.29 | -53.85 | 2 | 7 | -1 | 106 | 409.223 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.89 | 3.55 | -42.17 | 2 | 7 | -1 | 106 | 409.223 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.89 | 3.49 | -49.98 | 2 | 7 | -1 | 106 | 409.223 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.26 | 5.31 | -36.66 | 4 | 7 | 1 | 101 | 411.239 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 5.11 | -18.01 | 3 | 7 | 0 | 103 | 410.231 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 5.23 | -14.29 | 3 | 7 | 0 | 103 | 410.231 | 3 | ↓ |