In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 8th, 2010 | 20 | No |
Popular Name: 2-methyl-N-[[2-methyl-5-(1,4-thiazepan-4-ylmethyl)-3-furyl]methyl]propan-1-amine 2-methyl-N-[[2-methyl-5-(1,4-thi…
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) | 2.49 | 9.85 | -95.93 | 3 | 3 | 2 | 34 | 298.496 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.