In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 4th, 2011 | 19 | Yes |
Popular Name: 5-[(1S)-1-[[(1S)-1-(cyclopropylmethyl)propyl]amino]ethyl]-2,4-dimethyl-1H-pyrimidin-6-one 5-[(1S)-1-[[(1S)-1-(cyclopropylm…
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) | 2.04 | 6.43 | -29.35 | 3 | 4 | 1 | 62 | 264.393 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.04 | 5.71 | -8.12 | 2 | 4 | 0 | 58 | 263.385 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.