In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 17 | No |
Popular Name: [4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazin-7-ylmethyl)thiadiazol-5-yl]hydrazine [4-(6,8-dihydro-5H-imidazo[1,2-a…
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) | -0.64 | 2.21 | -50.33 | 4 | 7 | 1 | 86 | 252.327 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.64 | -0.03 | -14.58 | 3 | 7 | 0 | 85 | 251.319 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.64 | 0.44 | -36.7 | 4 | 7 | 1 | 86 | 252.327 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.64 | 2.04 | -127.31 | 5 | 7 | 2 | 88 | 253.335 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.