In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2010 | 19 | Yes |
Popular Name: N'-[2-[4-(cyclopropylmethyl)piperazin-1-yl]ethyl]-N,N-dimethyl-propane-1,3-diamine N'-[2-[4-(cyclopropylmethyl)pipe…
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) | 0.84 | 7.28 | -165.13 | 4 | 4 | 3 | 29 | 271.473 | 9 | ↓ |
Hi High (pH 8-9.5) | 0.84 | 2.51 | -40.23 | 2 | 4 | 1 | 26 | 269.457 | 9 | ↓ |
Mid Mid (pH 6-8) | 0.84 | 4.78 | -92.52 | 3 | 4 | 2 | 28 | 270.465 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.