In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 18th, 2011 | 17 | Yes |
Popular Name: (1R)-1-cyclopropyl-N,N'-diethyl-N'-[[(2S)-tetrahydrofuran-2-yl]methyl]ethane-1,2-diamine (1R)-1-cyclopropyl-N,N'-diethyl-…
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) | 2.11 | 7.28 | -102.85 | 3 | 3 | 2 | 30 | 242.407 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.11 | 6.53 | -28.27 | 2 | 3 | 1 | 26 | 241.399 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.11 | 5.96 | -27.77 | 2 | 3 | 1 | 29 | 241.399 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.