In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 10th, 2011 | 20 | Yes |
Popular Name: 2-[[methyl-[(5-methyl-2-furyl)methyl]amino]methyl]-3H-thieno[3,2-d]pyrimidin-4-one 2-[[methyl-[(5-methyl-2-furyl)me…
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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) | 1.99 | 4.37 | -47.88 | 1 | 5 | 0 | 66 | 289.36 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 4.74 | -14.82 | 1 | 5 | 0 | 62 | 289.36 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.53 | 7.07 | -53.56 | 2 | 5 | 1 | 63 | 290.368 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.