In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 16 | Yes |
Popular Name: (3R)-N1-cyclopropyl-N3-methyl-N3-[[(2S)-tetrahydrofuran-2-yl]methyl]butane-1,3-diamine (3R)-N1-cyclopropyl-N3-methyl-N3…
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) | 1.47 | 4.92 | -36.13 | 2 | 3 | 1 | 29 | 227.372 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 6.75 | -101.64 | 3 | 3 | 2 | 30 | 228.38 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.