In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 16th, 2011 | 18 | Yes |
Popular Name: N-(cyclopropylmethyl)-N-[[(3R)-3-propyl-3-piperidyl]methyl]propan-1-amine N-(cyclopropylmethyl)-N-[[(3R)-3…
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) | 3.44 | 9.37 | -101.15 | 3 | 2 | 2 | 21 | 254.462 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.44 | 8.03 | -31.98 | 2 | 2 | 1 | 16 | 253.454 | 8 | ↓ |
Mid Mid (pH 6-8) | 3.44 | 7.76 | -38.6 | 2 | 2 | 1 | 20 | 253.454 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.